Vitas-M small molecule compound

3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-7-hydroxy-4-methyl-2H-chromen-2-one

Catalog ID
STL350662
SMILES Oc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1cccc(c1)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 C22H21ClN2O4 MW 412.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O4/c1-14-18-6-5-17(26)12-20(18)29-22(28)19(14)13-21(27)25-9-7-24(8-10-25)16-4-2-3-15(23)11-16/h2-6,11-12,26H,7-10,13H2,1H3
InChIKey
VLKCMHFRMLTVFC-UHFFFAOYSA-N
Synonyms
929965-77-5
3(2(4(3chlorophenyl)piperazin1yl)2oxoethyl)7hydroxy4methyl2Hchromen2one
3(2(4(3chlorophenyl)piperazin1yl)2oxoethyl)7hydroxy4methylchromen2one
929965775
CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl
InChI=1SC22H21ClN2O4c114186517(26)1220(18)2922(28)19(14)1321(27)259724(81025)1642315(23)1116h26111226H71013H21H3
MFCD09848998
ZINC000008993282
ZINC08993282
ZINC8993282

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Available files

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