Vitas-M small molecule compound
5-[4-(benzyloxy)-3-methoxyphenyl]-1,3-dimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Catalog ID
STK981158
SMILES COc1cc(ccc1OCc1ccccc1)C1C2=C(CCCC2=O)Nc2c1c(=O)n(c(=O)n2C)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 C27H27N3O5 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5/c1-29-25-24(26(32)30(2)27(29)33)22(23-18(28-25)10-7-11-19(23)31)17-12-13-20(21(14-17)34-3)35-15-16-8-5-4-6-9-16/h4-6,8-9,12-14,22,28H,7,10-11,15H2,1-3H3InChIKey
XCPQUXZOGMYZDW-UHFFFAOYSA-NSynonyms
5(3methoxy4phenylmethoxyphenyl)13dimethyl78910tetrahydro5Hpyrimido(45b)quinoline246trione
5(4(benzyloxy)3methoxyphenyl)13dimethyl58910tetrahydropyrimido(45b)quinoline246(1H3H7H)trione
CN1C2=C(C(C3=C(N2)CCCC3=O)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)C(=O)N(C1=O)C
InChI=1SC27H27N3O5c1292524(26(32)30(2)27(29)33)22(2318(2825)1071119(23)31)17121320(21(1417)343)3515168546916h468912142228H7101115H213H3
MFCD03133232
ZINC000017144437
ZINC000017144439
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