Vitas-M small molecule compound
(2E)-2-cyano-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}-N-(3-methoxypropyl)prop-2-enamide
Catalog ID
STK881512
SMILES COCCCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2C)N1CCN(CC1)c1ccc(cc1)OC)/C#N
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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 C28H32N6O4 MW 516.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N6O4/c1-20-6-4-12-34-25(20)31-26(24(28(34)36)18-21(19-29)27(35)30-11-5-17-37-2)33-15-13-32(14-16-33)22-7-9-23(38-3)10-8-22/h4,6-10,12,18H,5,11,13-17H2,1-3H3,(H,30,35)/b21-18+InChIKey
GDORBOFCLCILPA-DYTRJAOYSA-NSynonyms
799770-66-4(2E)2cyano3(2(4(4methoxyphenyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(3methoxypropyl)prop2enamide
(E)2cyano3(2(4(4methoxyphenyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(3methoxypropyl)acrylamide
(E)2CYANO3(2(4(4METHOXYPHENYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)N(3METHOXYPROPYL)PROP2ENAMIDE
799770664
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCCCOC)N3CCN(CC3)C4=CC=C(C=C4)OC
COCCCNC(=O)C(=Cc1c(nc2n(c1=O)cccc2C)N1CCN(CC1)c1ccc(cc1)OC)C#N
InChI=1SC28H32N6O4c12064123425(20)3126(24(28(34)36)1821(1929)27(35)3011517372)33151332(141633)227923(383)10822h46101218H5111317H213H3(H3035)b2118+
MFCD03671550
ZINC000009075530
ZINC9075530
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.