Vitas-M small molecule compound

methyl 5-(4-chlorophenyl)-5-hydroxy-1-(phenylcarbonyl)-4,5-dihydro-1H-pyrazole-3-carboxylate

Catalog ID
STK015281
SMILES COC(=O)C1=NN(C(C1)(O)c1ccc(cc1)Cl)C(=O)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H15ClN2O4 MW 358.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O4/c1-25-17(23)15-11-18(24,13-7-9-14(19)10-8-13)21(20-15)16(22)12-5-3-2-4-6-12/h2-10,24H,11H2,1H3
InChIKey
WHGMVXVYWKNPPH-UHFFFAOYSA-N
Synonyms
78051-37-3
78051373
COC(=O)C1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)C3=CC=CC=C3
COC(=O)C1=NN(C(C1)(O)c1ccc(cc1)Cl)C(=O)c1ccccc1
InChI=1SC18H15ClN2O4c12517(23)151118(24137914(19)10813)21(2015)16(22)125324612h21024H11H21H3
methyl1benzoyl5(4chlorophenyl)5hydroxy45dihydro1Hpyrazole3carboxylate
METHYL1BENZOYL5(4CHLOROPHENYL)5HYDROXY4HPYRAZOLE3CARBOXYLATE
METHYL5(4CHLOROPHENYL)5HYDROXY1(PHENYLCARBONYL)2PYRAZOLINE3CARBOXYLATE
METHYL5(4CHLOROPHENYL)5HYDROXY1(PHENYLCARBONYL)45DIHYDRO1HPYRAZOLE3CARBOXYLATE
MFCD00508685
STK015281
ZINC000000854835
ZINC000000854836

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.