Vitas-M small molecule compound

7,8-dihydroxy-4-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2H-chromen-2-one

Catalog ID
STK617221
SMILES O=C(N1CCN(CC1)c1ccccc1)Cc1c(=O)oc2c(c1C)ccc(c2O)O

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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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c1-14-16-7-8-18(25)20(27)21(16)29-22(28)17(14)13-19(26)24-11-9-23(10-12-24)15-5-3-2-4-6-15/h2-8,25,27H,9-13H2,1H3
InChIKey
JFXUQEFWXOHXEG-UHFFFAOYSA-N
Synonyms
879478-95-2
78dihydroxy4methyl3(2oxo2(4phenylpiperazin1yl)ethyl)2Hchromen2one
78DIHYDROXY4METHYL3(2OXO2(4PHENYLPIPERAZIN1YL)ETHYL)CHROMEN2ONE
879478952
CC1=C(C(=O)OC2=C1C=CC(=C2O)O)CC(=O)N3CCN(CC3)C4=CC=CC=C4
InChI=1SC22H22N2O5c114167818(25)20(27)21(16)2922(28)17(14)1319(26)2411923(101224)155324615h282527H913H21H3
MFCD06785643
ZINC000006660365
ZINC06660365
ZINC6660365

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Available files

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