Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-methyl-7-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethoxy}-4H-chromen-4-one
Catalog ID
STK628654
SMILES COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=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 C27H26N4O5 MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O5/c1-18-25(19-4-6-20(34-2)7-5-19)26(33)22-9-8-21(16-23(22)36-18)35-17-24(32)30-12-14-31(15-13-30)27-28-10-3-11-29-27/h3-11,16H,12-15,17H2,1-2H3InChIKey
FIHLNFHKBNIQLL-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)2methyl7(2oxo2(4(pyrimidin2yl)piperazin1yl)ethoxy)4Hchromen4one
3(4methoxyphenyl)2methyl7(2oxo2(4pyrimidin2ylpiperazin1yl)ethoxy)chromen4one
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CCN(CC3)C4=NC=CC=N4)C5=CC=C(C=C5)OC
InChI=1SC27H26N4O5c11825(194620(342)7519)26(33)229821(1623(22)3618)351724(32)30121431(151330)2728103112927h31116H121517H212H3
MFCD09790088
ZINC000009575402
ZINC09575402
ZINC9575402
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