Vitas-M small molecule compound
5-hydroxy-4,7-dimethyl-3-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-2H-chromen-2-one
Catalog ID
STL236320
SMILES Cc1cc(O)c2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1ncccn1
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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 C21H22N4O4 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4/c1-13-10-16(26)19-14(2)15(20(28)29-17(19)11-13)12-18(27)24-6-8-25(9-7-24)21-22-4-3-5-23-21/h3-5,10-11,26H,6-9,12H2,1-2H3InChIKey
QXCNRCDVGUWRFO-UHFFFAOYSA-NSynonyms
920442-97-35hydroxy47dimethyl3(2oxo2(4(pyrimidin2yl)piperazin1yl)ethyl)2Hchromen2one
5hydroxy47dimethyl3(2oxo2(4pyrimidin2ylpiperazin1yl)ethyl)chromen2one
920442973
CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCN(CC3)C4=NC=CC=N4)C)C(=C1)O
InChI=1SC21H22N4O4c1131016(26)1914(2)15(20(28)2917(19)1113)1218(27)246825(9724)21224352321h35101126H6912H212H3
MFCD08749157
ZINC000013629111
ZINC13629111
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