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Chemical Structure| 5368-37-6 Chemical Structure| 5368-37-6

Structure of 5368-37-6

Chemical Structure| 5368-37-6

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Product Details of [ 5368-37-6 ]

CAS No. :5368-37-6
Formula : C11H10N2O3
M.W : 218.21
SMILES Code : O=C(O)CCC(N1)=NC2=C(C=CC=C2)C1=O
MDL No. :MFCD03955531
InChI Key :HYSISEGNFBAVMJ-UHFFFAOYSA-N
Pubchem ID :135449434

Safety of [ 5368-37-6 ]

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

Application In Synthesis of [ 5368-37-6 ]

* 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 [ 5368-37-6 ]

[ 5368-37-6 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 2886-33-1 ]
  • [ 5368-37-6 ]
  • C29H27N3O6 [ No CAS ]
  • 2
  • [ 10272-49-8 ]
  • [ 5368-37-6 ]
  • 2-[3-oxo-3-(4-phenyl-1-piperidyl)propyl]-3H-quinazolin-4-one [ No CAS ]
YieldReaction ConditionsOperation in experiment
25% With sodium carbonate; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In N,N-dimethyl-formamide; at 20℃; for 18h;Inert atmosphere; To a stirred solution of 3-(4-oxo-3H-quinazolin-2-yl)propanoic acid (200 mg, 0.917 mmol)and <strong>[10272-49-8]4-phenylpiperidine hydrochloride</strong> (217 mg, 1.1 mmol) in dry DMF (1.5 mL), EDC.HCl(264 mg, 1.375 mmol), HOBt (187 mg, 1.38 mmol) and Na2C03 (292 mg, 2.75 mmol) wereadded at RT under argon atmosphere. The reaction mixture was stirred at RT for 18 h (TLCindicated complete consumption of starting material), quenched with ice cold water (15 mL)and stirred for 30 minutes. The precipitate was filtered and the solid was washed with water(10 mL) and dried under vacuum. The crude product was purified by column chromatography(100-200 silica gel, 25 g, 5% MeOH-DCM) to furnish the 2-[3-oxo-3-(4-phenyl-1-piperidyl)propyl]-3H-quinazolin-4-one (30 mg, 25%) as an off-white solid. 1H NMR [300 MHz, DMSO-d6]: J 12.21 (s, 1H), 8.08 (d, J = 6.6 Hz, 1H), 7.79-7.73 (m,1H), 7.57-7.52 (m, 1H), 7.48-7.43 (m, 1H), 7.38-7.22 (m, 5H), 4.51 (d, J = 12.6 Hz, 1H), 4.07(d, J = 13.8 Hz, 1H), 3.14 (t, J = 12.6 Hz, 4H), 2.94-2.81 (m, 3H), 2.64-2.57 (m, 1H), 1.84-1.73 (m, 1H), 1.66-1.62 (m, 1 H), 1.42-1.33 (m, 1H).LCMS: m/z: 362.5 [M+Ht.
 

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