Home Cart 0 Sign in  

[ CAS No. 1150561-61-7 ]

{[proInfo.proName]} ,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
Chemical Structure| 1150561-61-7
Chemical Structure| 1150561-61-7
Structure of 1150561-61-7 * Storage: {[proInfo.prStorage]}

Quality Control of [ 1150561-61-7 ]

Related Doc. of [ 1150561-61-7 ]

SDS
Alternatived Products of [ 1150561-61-7 ]
Alternatived Products of [ 1150561-61-7 ]

Product Details of [ 1150561-61-7 ]

CAS No. :1150561-61-7 MDL No. :MFCD12026094
Formula : C13H17BF3NO3 Boiling Point : -
Linear Structure Formula :- InChI Key :-
M.W :303.09 g/mol Pubchem ID :-
Synonyms :

Safety of [ 1150561-61-7 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P305+P351+P338 UN#:N/A
Hazard Statements:H302-H315-H319-H335 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 1150561-61-7 ]

  • Downstream synthetic route of [ 1150561-61-7 ]

[ 1150561-61-7 ] Synthesis Path-Downstream   1~14

  • 1
  • [ 1150561-61-7 ]
  • [ 1445651-35-3 ]
  • C25H26F3N3O4 [ No CAS ]
YieldReaction ConditionsOperation in experiment
With bis-triphenylphosphine-palladium(II) chloride; potassium phosphate In water; acetonitrile at 125℃; for 0.25h; Microwave irradiation; (S)-3-[4-(5-Chloro-6-methoxy-pyridin-3-yl)-quinolin-6-yloxy]-pyrrolidine-1-carboxylic acid tert-butyl ester General procedure: 3-chloro-2-methoxypyridine-5-boronic acid (CAS registry 942438-89-3) (57 mg, 0.30 mmol) followed by K3P04 (CAS registry 7778-53-2) (97.0 mg, 0.46 mmol), PdCI2(PPh3)2 (CAS registry 13965-03-2) (10.7 mg, 0.01 mmol) and finally water (0.2 ml) were added to a mixture of ((S)-3-(4-bromo-quinolin-6-yloxy)-pyrrolidine-1 -carboxylic acid tert-butyl ester (120 mg, 0.30 mmol) in acetonitrile (2 ml) in a microwave tube. The tube was capped and the reaction mixture was heated in a microwave reactor at 125°C for 15 min. The mixture was diluted with DCM and washed with sat. aq. NaHC03 soln. and the organic solution was separated through a phase separating cartridge affording a yellow solution. The crude product was purified by flash chromatography on silica gel (cyclohexane / EtOAc 100:0 to 0:100) to provide the title compound (1 14 mg, 82% yield). HPLC RtMO1=1.27 min; ESIMS: 456, 458 [(M+H)+].1H NMR (400 MHz, CDCI3): δ 8.80 (d, 1 H), 8.33 (d, 1 H), 8.16 (d, 1 H), 8.04 (d, 1 H), 7.49 (dd, 1 H), 7.46 (d, 1 H), 7.10 (br. s., 1 H) , 5.06 (m, 1 H), 4.03 (s, 3H), 3.57-3.36 (m, 4H), 2.10 (br. s., 2H ), 1.37 (d, 9H).
  • 2
  • [ 1214377-42-0 ]
  • [ 73183-34-3 ]
  • [ 1150561-61-7 ]
YieldReaction ConditionsOperation in experiment
With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium acetate; In 1,4-dioxane; at 120℃; for 3h;Inert atmosphere; <strong>[1214377-42-0]3-trifluoromethyl-2-methoxy-5-bromopyridine</strong> (0.50 g, 1.95 mmol)0.12 g (2.34 mmol) of diphenylolate borate,0.57 g (5.85 mmol) of potassium acetate and 0.10 g (0.14 mmol) of Pd (dppf) Cl2 in 100 mL eggplant vials, Adding dioxane 12mL, nitrogen protection, heating at 120 reflux 3h,To give the product containing 3- (4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl) -5-methanesulfonamido-6-methoxypyridine Of the reaction system, cooled to room temperature,To this system was added 0.37 g (1.63 mmol) of 2-amino-6-bromobenzothiazole,Potassium carbonate 0.67 g (4.88 mmol)Pd (dppf) Cl2 0.15 g (0.20 mmol) and water 3 mL,Nitrogen protection,120 heating reflux 6h,Cooled to room temperature, steamed to remove the solvent, silica gel column chromatography separation and purification,Eluent (V / V): chloroform / methanol = 50/1, gave 0.40 g of a white solid, yield: 75.43%
  • 3
  • [ 15864-32-1 ]
  • [ 1150561-61-7 ]
  • 6-(5-trifluoromethyl-6-methoxy-3-pyridyl)-2-aminobenzothiazole [ No CAS ]
YieldReaction ConditionsOperation in experiment
75.43% With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium carbonate In water at 120℃; for 6h; Inert atmosphere; 18.1 (S) -N1- [6- (5-Trifluoromethyl-6-methoxy-3-pyridyl) -2-benzothiazolyl] -1,2-tetrahydropyrrole dicarboxamide (T18) synthesis 3-trifluoromethyl-2-methoxy-5-bromopyridine (0.50 g, 1.95 mmol)0.12 g (2.34 mmol) of diphenylolate borate,0.57 g (5.85 mmol) of potassium acetate and 0.10 g (0.14 mmol) of Pd (dppf) Cl2 in 100 mL eggplant vials, Adding dioxane 12mL, nitrogen protection, heating at 120 reflux 3h,To give the product containing 3- (4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl) -5-methanesulfonamido-6-methoxypyridine Of the reaction system, cooled to room temperature,To this system was added 0.37 g (1.63 mmol) of 2-amino-6-bromobenzothiazole,Potassium carbonate 0.67 g (4.88 mmol)Pd (dppf) Cl2 0.15 g (0.20 mmol) and water 3 mL,Nitrogen protection,120 heating reflux 6h,Cooled to room temperature, steamed to remove the solvent, silica gel column chromatography separation and purification,Eluent (V / V): chloroform / methanol = 50/1, gave 0.40 g of a white solid, yield: 75.43%
  • 4
  • [ 1150561-61-7 ]
  • (S)-N1-[6-(5-trifluoromethyl-6-methoxy-3-pyridyl)-2-benzothiazolyl]-1,2-tetrahydropyrrole dicarboxamide [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1.1: potassium carbonate; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride / water / 6 h / 120 °C / Inert atmosphere 2.1: N,N-dimethyl-formamide / 24 h / 20 °C 2.2: 5 h / 20 °C
  • 5
  • [ 1150561-61-7 ]
  • C20H18F3N3O2 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: bis-triphenylphosphine-palladium(II) chloride; potassium phosphate / water; acetonitrile / 0.25 h / 125 °C / Microwave irradiation 2: trifluoroacetic acid / dichloromethane / 18 h / 20 °C
  • 6
  • [ 1150561-61-7 ]
  • [ 1445650-92-9 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: bis-triphenylphosphine-palladium(II) chloride; potassium phosphate / water; acetonitrile / 0.25 h / 125 °C / Microwave irradiation 2: trifluoroacetic acid / dichloromethane / 18 h / 20 °C 3: N-[([(1E)-1-cyano-2-ethoxy-2-oxoethylidene]amino}oxy)(morpholin-4-yl)methylene]-N-methylmethanaminium hexafluorophosphate; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 20 °C
  • 7
  • [ 1150561-61-7 ]
  • (S)-tert-butyl 3-((6-bromoquinazolin-4-yl)amino)piperidine-1-carboxylate [ No CAS ]
  • (S)-tert-butyl 3-((6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)quinazolin-4-yl)amino)piperidine-1-carboxylate [ No CAS ]
YieldReaction ConditionsOperation in experiment
81% With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium carbonate In water Reflux; Inert atmosphere; 4.1.4 (S)-tert-Butyl 3-((6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)quinazolin-4-yl)amino)piperidine-1-carboxylate (12c) To a solution mixture of 11 (350mg, 0.86mmol) in DME/H2O (8mL/2mL), were added the 2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl) pyridine (561mg, 1.85mmol), PdCl2(dppf) (73.2mg, 0.1mmol) and Na2CO3 (182mg, 1.72mmol). The mixture was refluxed under N2 atmosphere for 4h and then the mixture was concentrated and purified by silica gel chromatography (CH2Cl2/CH3OH, 20:1) to give compound 12c (510mg, 81%) as a brown solid. MS (ESI) m/z: [M+H]+=504.2.
  • 8
  • [ 1150561-61-7 ]
  • C24H26F3N5O3 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium carbonate / water / Reflux; Inert atmosphere 2: trifluoroacetic acid / dichloromethane / 2 h / 20 °C 3: N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate / dichloromethane / 20 °C
  • 9
  • [ 1150561-61-7 ]
  • C20H20F3N5O [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; sodium carbonate / water / Reflux; Inert atmosphere 2: trifluoroacetic acid / dichloromethane / 2 h / 20 °C
  • 10
  • [ 1150561-61-7 ]
  • (S)-2-((6-bromoquinazolin-4-yl)amino)-1-(4-methylpiperazin-1-yl)propan-1-one [ No CAS ]
  • (S)-2-((6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)quinazolin-4-yl)amino)-1-(4-methylpiperazin-1-yl)propan-1-one [ No CAS ]
YieldReaction ConditionsOperation in experiment
47.7% With palladium (II) [1,1'-bis(diphenylphosphanyl)ferrocene] dichloride; anhydrous sodium carbonate In 1,2-dimethoxyethane; lithium hydroxide monohydrate for 2.5h; Reflux; Inert atmosphere; 14 (S)-N-butyl-2-((6-(6-methoxypyridin-3-yl)quinazolin-4-yl)amino)propanamide (Compound 1) General procedure: Take the intermediate (S)-2-((6-bromo-4-quinazolinyl)amino)-N-butylpropionamide (280 mL, 0.80 mmol), 2-methoxy-5-pyridineboronic acid (184 mg , 1.20 mmol), Na2CO3 (170 mg, 1.60 mmol), PdCl2(dppf) (71 mg, 0.097 mmol), ethylene glycol dimethyl ether (8 mL) and H2O (2 mL) N2 protection, heated to reflux for about 2.5 h, TLC showed The reaction is complete. After cooling, evaporation to dryness under reduced pressure was performed by column chromatography to obtain 65 mg of a white solid with a yield of 63.4%.
  • 11
  • [ 1150561-61-7 ]
  • C16H21ClN6O [ No CAS ]
  • (S)-2-((6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)pyrido[3,2-d]pyrimidin-4-yl)amino)-1-(4-methylpiperazin-1-yl)butanone [ No CAS ]
YieldReaction ConditionsOperation in experiment
33.4% With palladium (II) [1,1'-bis(diphenylphosphanyl)ferrocene] dichloride; anhydrous sodium carbonate In 1,2-dimethoxyethane; lithium hydroxide monohydrate for 2.5h; Reflux; 24 (S)-N-butyl-2-((6-(6-methoxypyridin-3-yl)quinazolin-4-yl)amino)propanamide (Compound 1) General procedure: Take the intermediate (S)-2-((6-bromo-4-quinazolinyl)amino)-N-butylpropionamide (280 mL, 0.80 mmol), 2-methoxy-5-pyridineboronic acid (184 mg , 1.20 mmol), Na2CO3 (170 mg, 1.60 mmol), PdCl2(dppf) (71 mg, 0.097 mmol), ethylene glycol dimethyl ether (8 mL) and H2O (2 mL) N2 protection, heated to reflux for about 2.5 h, TLC showed The reaction is complete. After cooling, evaporation to dryness under reduced pressure was performed by column chromatography to obtain 65 mg of a white solid with a yield of 63.4%.
  • 12
  • [ 1150561-61-7 ]
  • C15H19ClN6O [ No CAS ]
  • (S)-2-((6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)pyrido[3,2-d]pyrimidin-4-yl)amino)-1-(4-methylpiperazin-1-yl)propan-1-one [ No CAS ]
YieldReaction ConditionsOperation in experiment
50.5% With palladium (II) [1,1'-bis(diphenylphosphanyl)ferrocene] dichloride; anhydrous sodium carbonate In 1,2-dimethoxyethane; lithium hydroxide monohydrate for 2.5h; Reflux; Inert atmosphere; 22 (S)-N-butyl-2-((6-(6-methoxypyridin-3-yl)quinazolin-4-yl)amino)propanamide (Compound 1) General procedure: Take the intermediate (S)-2-((6-bromo-4-quinazolinyl)amino)-N-butylpropionamide (280 mL, 0.80 mmol), 2-methoxy-5-pyridineboronic acid (184 mg , 1.20 mmol), Na2CO3 (170 mg, 1.60 mmol), PdCl2(dppf) (71 mg, 0.097 mmol), ethylene glycol dimethyl ether (8 mL) and H2O (2 mL) N2 protection, heated to reflux for about 2.5 h, TLC showed The reaction is complete. After cooling, evaporation to dryness under reduced pressure was performed by column chromatography to obtain 65 mg of a white solid with a yield of 63.4%.
  • 13
  • [ 1150561-61-7 ]
  • (S)-1-(3-((6-bromothieno[2,3-d]pyrimidin-4-yl)amino)pyrrolidin-1-yl)propan-1-one [ No CAS ]
  • (S)-1-(3-((6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)thieno-[2,3-d]pyrimidin-4-yl)amino)pyrrolidin-1-yl)propan-1-one [ No CAS ]
YieldReaction ConditionsOperation in experiment
75% With palladium (II) [1,1'-bis(diphenylphosphanyl)ferrocene] dichloride; potassium carbonate In 1,4-dioxane; lithium hydroxide monohydrate at 100℃; for 5h; Inert atmosphere;
  • 14
  • [ 1150561-61-7 ]
  • (S)-1-(3-((6-bromothieno[2,3-d]pyrimidin-4-yl)oxy)pyrrolidin-1-yl)propan-1-one [ No CAS ]
  • (S)-1-(3-((6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)thieno-[2,3-d]pyrimidin-4-yl)oxy)pyrrolidin-1-yl)propan-1-one [ No CAS ]
YieldReaction ConditionsOperation in experiment
58% With palladium (II) [1,1'-bis(diphenylphosphanyl)ferrocene] dichloride; potassium carbonate In 1,4-dioxane; lithium hydroxide monohydrate at 100℃; for 5h; Inert atmosphere;
Historical Records

Related Functional Groups of
[ 1150561-61-7 ]

Trifluoromethyls

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Fluorinated Building Blocks

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Organoboron

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Ethers

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Organoboron

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Organoboron

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Esters

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 2096330-00-4

[ 2096330-00-4 ]

2-Methoxy-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.91

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Related Parent Nucleus of
[ 1150561-61-7 ]

Pyridines

Chemical Structure| 849934-84-5

[ 849934-84-5 ]

2-Ethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.98

Chemical Structure| 1334607-81-6

[ 1334607-81-6 ]

2-Isopropoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridine

Similarity: 0.97

Chemical Structure| 1256359-93-9

[ 1256359-93-9 ]

2-Isobutoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)pyridine

Similarity: 0.89

Chemical Structure| 1083168-83-5

[ 1083168-83-5 ]

2-Methoxy-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Similarity: 0.87