Vitas-M small molecule compound

methyl 4-({[1-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)piperidin-3-yl]carbonyl}amino)benzoate

Catalog ID
STK262682
SMILES COC(=O)c1ccc(cc1)NC(=O)C1CCCN(C1)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl

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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 C29H26ClN3O4 MW 516.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClN3O4/c1-37-29(36)19-9-12-22(13-10-19)31-27(34)20-8-5-15-33(17-20)26-25(18-6-3-2-4-7-18)23-16-21(30)11-14-24(23)32-28(26)35/h2-4,6-7,9-14,16,20H,5,8,15,17H2,1H3,(H,31,34)(H,32,35)
InChIKey
OBGYIDMQAWKHDA-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5
COC(=O)c1ccc(cc1)NC(=O)C1CCCN(C1)c1c(=O)(nH)c2c(c1c1ccccc1)cc(cc2)Cl
InChI=1SC29H26ClN3O4c13729(36)1991222(131019)3127(34)20851533(1720)2625(186324718)231621(30)111424(23)3228(26)35h24679141620H581517H21H3(H3134)(H3235)
methyl4(((1(6chloro2oxo4phenyl12dihydroquinolin3yl)piperidin3yl)carbonyl)amino)benzoate
METHYL4((1(6CHLORO2OXO4PHENYL1HQUINOLIN3YL)PIPERIDINE3CARBONYL)AMINO)BENZOATE
METHYL4((1(6CHLORO2OXO4PHENYL3HYDROQUINOLYL)3PIPERIDYL)CARBONYLAMINO)BENZOATE
METHYL4(1(6CHLORO2OXO4PHENYL12DIHYDROQUINOLIN3YL)PIPERIDINE3CARBOXAMIDO)BENZOATE
MFCD07773579
ZINC000008759050
ZINC000008759051

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Available files

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