Vitas-M small molecule compound
5-[3-(benzyloxy)phenyl]-1,3-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Catalog ID
STK981153
SMILES O=C1CCCC2=C1C(c1cccc(c1)OCc1ccccc1)c1c(N2)n(C)c(=O)n(c1=O)C
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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 C26H25N3O4 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4/c1-28-24-23(25(31)29(2)26(28)32)21(22-19(27-24)12-7-13-20(22)30)17-10-6-11-18(14-17)33-15-16-8-4-3-5-9-16/h3-6,8-11,14,21,27H,7,12-13,15H2,1-2H3InChIKey
JGBGRWQIONQJAF-UHFFFAOYSA-NSynonyms
13dimethyl5(3phenylmethoxyphenyl)78910tetrahydro5Hpyrimido(45b)quinoline246trione
5(3(benzyloxy)phenyl)13dimethyl58910tetrahydropyrimido(45b)quinoline246(1H3H7H)trione
CN1C2=C(C(C3=C(N2)CCCC3=O)C4=CC(=CC=C4)OCC5=CC=CC=C5)C(=O)N(C1=O)C
InChI=1SC26H25N3O4c1282423(25(31)29(2)26(28)32)21(2219(2724)1271320(22)30)171061118(1417)3315168435916h36811142127H7121315H212H3
MFCD03133230
ZINC000017144444
ZINC000017144446
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