Vitas-M small molecule compound

cyclohexyl 4-(3-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK372605
SMILES Fc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCC1

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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 C23H26FNO3 MW 383.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26FNO3/c1-14-20(23(27)28-17-9-3-2-4-10-17)21(15-7-5-8-16(24)13-15)22-18(25-14)11-6-12-19(22)26/h5,7-8,13,17,21,25H,2-4,6,9-12H2,1H3
InChIKey
WMORBABSTMFSBY-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)F)C(=O)OC4CCCCC4
cyclohexyl4(3fluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(3fluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC23H26FNO3c11420(23(27)281793241017)21(1575816(24)1315)2218(2514)1161219(22)26h57813172125H246912H21H3
MFCD00753257
ZINC000019536320
ZINC000019536323

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Available files

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