Vitas-M small molecule compound
5,7-dimethoxy-4-methyl-3-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)-2H-chromen-2-one
Catalog ID
STL008951
SMILES COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)N1CCN(CC1)C/C=C/c1ccccc1
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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 C27H30N2O5 MW 462.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O5/c1-19-22(27(31)34-24-17-21(32-2)16-23(33-3)26(19)24)18-25(30)29-14-12-28(13-15-29)11-7-10-20-8-5-4-6-9-20/h4-10,16-17H,11-15,18H2,1-3H3/b10-7+InChIKey
PUMPODHAWYEZPL-JXMROGBWSA-NSynonyms
929871-16-9(E)3(2(4cinnamylpiperazin1yl)2oxoethyl)57dimethoxy4methyl2Hchromen2one
57dimethoxy4methyl3(2oxo2(4((2E)3phenylprop2en1yl)piperazin1yl)ethyl)2Hchromen2one
57dimethoxy4methyl3(2oxo2(4((E)3phenylprop2enyl)piperazin1yl)ethyl)chromen2one
929871169
CC1=C(C(=O)OC2=CC(=CC(=C12)OC)OC)CC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4
COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)N1CCN(CC1)CC=Cc1ccccc1
InChI=1SC27H30N2O5c11922(27(31)34241721(322)1623(333)26(19)24)1825(30)29141228(131529)11710208546920h4101617H111518H213H3b107+
MFCD08749264
ZINC000013629428
ZINC13629428
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