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Chemical Structure| 52385-79-2 Chemical Structure| 52385-79-2

Structure of 52385-79-2

Chemical Structure| 52385-79-2

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Product Details of [ 52385-79-2 ]

CAS No. :52385-79-2
Formula : C10H13ClN2
M.W : 196.68
SMILES Code : ClC1=CC=CC(=C1)C2CNCCN2
MDL No. :MFCD00799218

Safety of [ 52385-79-2 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 52385-79-2 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 52385-79-2 ]

[ 52385-79-2 ] Synthesis Path-Downstream   1~5

  • 1
  • [ 860625-20-3 ]
  • [ 52385-79-2 ]
  • 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-[3-(2-piperazinyl)phenyl]-1H-indole-7-carboxamide trifluoroacetate [ No CAS ]
YieldReaction ConditionsOperation in experiment
27.4% With potassium carbonate;tetrakis(triphenylphosphine)palladium (0); In 1,4-dioxane; dichloromethane; water; Example 300 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-[3-(2-piperazinyl)phenyl]-1H-indole-7-carboxamide trifluoroacetate To a solution of 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxamide (60 mg, 0.13 mmol) in dioxane (1.5 mL) and water (0.5 mL) was added <strong>[52385-79-2]2-(3-chlorophenyl)piperazine</strong> (63.7 mg, 0.325 mmol) and potassium carbonate (90 mg, 0.650 mmol). This mixture was degassed for 5 min then tetrakis(triphenylphosphine)palladium(0) (12 mg, 0.011 mmol) was added. The resulting mixture was reacted in a microwave for 30 min at 160 C. The solid was filtered off and all solvents were evaporated. The resulting solution was re-dissolved in dichloromethane and separator was used to remove water. The mixture was concentrated to give organic solvent and then purified by Gilson Preparatory HPLC to give 21.7 mg of the title compound (27.4%). LC/MS=m/z 496.4 [M+H] Ret. Time: 1.28 min.
  • 2
  • [ 860625-20-3 ]
  • [ 52385-79-2 ]
  • [ 76-05-1 ]
  • 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-[3-(2-piperazinyl)phenyl]-1H-indole-7-carboxamide trifluoroacetate [ No CAS ]
YieldReaction ConditionsOperation in experiment
27.4% Example 300: 3-ri-(ethylsulfonv0-4-piperidinyl1-5-r3-(2-piperazinv0phenv?-1H- indole-7-carboxamide trifluoroacetate; EPO <DP n="264"/>To a solution of 3-[1 -(ethylsulfonyl)-4-piperidinyl]-5-(4,4,5,5-tetramethyl-1 ,3,2- dioxaborolan-2-yl)-1 /-/-indole-7-carboxamide (60 mg, 0.13 mmol) in dioxane (1.5 ml_) and water (0.5 ml_) was added <strong>[52385-79-2]2-(3-chlorophenyl)piperazine</strong> (63.7 mg, 0.325 mmol) and potassium carbonate (90 mg, 0.650 mmol). This mixture was degassed for 5 min then tetrakis(triphenylphosphine)palladium(0) (12 mg, 0.011 mmol) was added. The resulting mixture was reacted in a microwave for 30 min at 160 C. The solid was filtered off and all solvents were evaporated. The resulting solution was re-dissolved in dichloromethane and separator was used to remove water. The mixture was concentrated to give organic solvent and then purified by Gilson Preparatory HPLC to give 21.7 mg of the title compound (27.4%). LC/MS = m/z 496.4 [M+H] Ret. Time: 1.28 min.
  • 3
  • [ 52385-79-2 ]
  • 7-((1-(3-bromobenzyl)-1H-pyrazol-4-yl)methyl)-ditrityl-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine [ No CAS ]
  • 7-((1-(3-(3-(3-chlorophenyl)piperazin-1-yl)benzyl)-1H-pyrazol-4-yl)methyl)-ditrityl-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine [ No CAS ]
  • 7-((1-(3-(3-phenylpiperazin-1-yl)benzyl)-1H-pyrazol-4-yl)methyl)-ditrityl-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine [ No CAS ]
YieldReaction ConditionsOperation in experiment
30% With tris-(dibenzylideneacetone)dipalladium(0); 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; sodium t-butanolate; In toluene; at 100.0℃;Inert atmosphere; 218A (65 mg, 0.075 mmol), <strong>[52385-79-2]2-(3-chlorophenyl)piperazine</strong> (29 mg, 0.15 mmol), BINAP (9 mg, 0.02 mmol), NaOtBu (36 mg, 0.37 mmol) andtris(dibenzylideneacetone)dipalladium(0) (6.9 mg, 7.5 imol) were charged to a vial, which was then evacuated and back-filled with argon (3x). Degassed toluene (0.25 mL) was added. The reaction mixture was stirred at 100 C overnight, then filtered through CELITE, and the solids rinsed with EtOAc. The filtrate was evaporated, and productpurified by flash chromatography to provide a mixture of 218B (22 mg, 30%), MS(ESI) m/z 984.2 (M+H). 7-(( 1 -(3 -(3 -Phenylpiperazin- 1 -yl)benzyl)- 1H-pyrazol-4-yl)methyl)- ditrityl-3H- [1 ,2,3jtriazolo [4,5 -bj pyridin-5 -amine was also obtained.
  • 4
  • [ 521969-44-8 ]
  • [ 52385-79-2 ]
  • 2-(3-(3-chlorophenyl)piperazin-1-yl)-3-methyl-6-(4-pyridyl)-3H-pyrimidin-4-one [ No CAS ]
  • 5
  • [ 503860-54-6 ]
  • [ 52385-79-2 ]
  • 2-(3-(3-chlorophenyl)piperazin-1-yl)-3-methyl-6-(4-pyrimidyl)-3H-pyrimidin-4-one [ No CAS ]
 

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