Vitas-M small molecule compound

ethyl 4-{[1-(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)piperidin-3-yl]carbonyl}piperazine-1-carboxylate

Catalog ID
STK262707
SMILES CCOC(=O)N1CCN(CC1)C(=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 C28H31ClN4O4 MW 523.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN4O4/c1-2-37-28(36)32-15-13-31(14-16-32)27(35)20-9-6-12-33(18-20)25-24(19-7-4-3-5-8-19)22-17-21(29)10-11-23(22)30-26(25)34/h3-5,7-8,10-11,17,20H,2,6,9,12-16,18H2,1H3,(H,30,34)
InChIKey
ACXGURKBOHHQQY-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)C1CCCN(C1)c1c(=O)(nH)c2c(c1c1ccccc1)cc(cc2)Cl
CCOC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5
ethyl4((1(6chloro2oxo4phenyl12dihydroquinolin3yl)piperidin3yl)carbonyl)piperazine1carboxylate
ETHYL4((1(6CHLORO2OXO4PHENYL3HYDROQUINOLYL)3PIPERIDYL)CARBONYL)PIPERAZINECARBOXYLATE
ETHYL4(1(6CHLORO2OXO4PHENYL12DIHYDROQUINOLIN3YL)PIPERIDINE3CARBONYL)PIPERAZINE1CARBOXYLATE
ethyl4(1(6chloro2oxo4phenyl1Hquinolin3yl)piperidine3carbonyl)piperazine1carboxylate
InChI=1SC28H31ClN4O4c123728(36)32151331(141632)27(35)20961233(1820)2524(197435819)221721(29)101123(22)3026(25)34h357810111720H269121618H21H3(H3034)
MFCD07626842
ZINC000008766630
ZINC000008766633

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Available files

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