Vitas-M small molecule compound

methyl 1-[(2-fluorophenyl)carbonyl]-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-3-carboxylate

Catalog ID
STK754821
SMILES COC(=O)C1=NN(C(C1)(O)c1ccccc1)C(=O)c1ccccc1F

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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 C18H15FN2O4 MW 342.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15FN2O4/c1-25-17(23)15-11-18(24,12-7-3-2-4-8-12)21(20-15)16(22)13-9-5-6-10-14(13)19/h2-10,24H,11H2,1H3
InChIKey
UIRFQHLJNWCYMC-UHFFFAOYSA-N
Synonyms

COC(=O)C1=NN(C(C1)(C2=CC=CC=C2)O)C(=O)C3=CC=CC=C3F
InChI=1SC18H15FN2O4c12517(23)151118(24127324812)21(2015)16(22)139561014(13)19h21024H11H21H3
methyl1((2fluorophenyl)carbonyl)5hydroxy5phenyl45dihydro1Hpyrazole3carboxylate
METHYL1(2FLUOROBENZOYL)5HYDROXY5PHENYL4HPYRAZOLE3CARBOXYLATE
MFCD00782016
ZINC000000062932
ZINC000000062933

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Available files

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