Vitas-M small molecule compound

propyl 4-(2-chlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK024468
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)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 C26H26ClNO3 MW 435.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO3/c1-3-13-31-26(30)23-16(2)28-21-14-18(17-9-5-4-6-10-17)15-22(29)25(21)24(23)19-11-7-8-12-20(19)27/h4-12,18,24,28H,3,13-15H2,1-2H3
InChIKey
ZFAYHMDKIHHFJC-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccccc1
CCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3Cl)C(=O)CC(C2)C4=CC=CC=C4)C
InChI=1SC26H26ClNO3c13133126(30)2316(2)28211418(1795461017)1522(29)25(21)24(23)1911781220(19)27h412182428H31315H212H3
MFCD00771332
propyl4(2chlorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
propyl4(2chlorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
STK024468
ZINC000002775342
ZINC000002775345

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Available files

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