Vitas-M small molecule compound

2-[(4-benzylpiperidin-1-yl)carbonyl]-6-chloro-7-methyl-4H-chromen-4-one

Catalog ID
STK518641
SMILES O=C(c1cc(=O)c2c(o1)cc(c(c2)Cl)C)N1CCC(CC1)Cc1ccccc1

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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 C23H22ClNO3 MW 395.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO3/c1-15-11-21-18(13-19(15)24)20(26)14-22(28-21)23(27)25-9-7-17(8-10-25)12-16-5-3-2-4-6-16/h2-6,11,13-14,17H,7-10,12H2,1H3
InChIKey
AJOUMEALQJJPNH-UHFFFAOYSA-N
Synonyms
905768-68-5
2((4benzylpiperidin1yl)carbonyl)6chloro7methyl4Hchromen4one
2(4benzylpiperidine1carbonyl)6chloro7methylchromen4one
905768685
CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)N3CCC(CC3)CC4=CC=CC=C4)Cl
InChI=1SC23H22ClNO3c115112118(1319(15)24)20(26)1422(2821)23(27)259717(81025)12165324616h2611131417H71012H21H3
MFCD12918299
ZINC000027749874
ZINC27749874

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Available files

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