Vitas-M small molecule compound
5-(2,5-dimethoxyphenyl)-1,8,8-trimethyl-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Catalog ID
STK981175
SMILES COc1ccc(c(c1)C1C2=C(Nc3c1c(=O)[nH]c(=O)n3C)CC(CC2=O)(C)C)OC
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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 C22H25N3O5 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O5/c1-22(2)9-13-17(14(26)10-22)16(12-8-11(29-4)6-7-15(12)30-5)18-19(23-13)25(3)21(28)24-20(18)27/h6-8,16,23H,9-10H2,1-5H3,(H,24,27,28)InChIKey
KVTFRBAGMBWZTA-UHFFFAOYSA-NSynonyms
5(25dimethoxyphenyl)188trimethyl57910tetrahydropyrimido(45b)quinoline246trione
5(25dimethoxyphenyl)188trimethyl58910tetrahydropyrimido(45b)quinoline246(1H3H7H)trione
CC1(CC2=C(C(C3=C(N2)N(C(=O)NC3=O)C)C4=C(C=CC(=C4)OC)OC)C(=O)C1)C
COc1ccc(c(c1)C1C2=C(Nc3c1c(=O)(nH)c(=O)n3C)CC(CC2=O)(C)C)OC
InChI=1SC22H25N3O5c122(2)91317(14(26)1022)16(12811(294)6715(12)305)1819(2313)25(3)21(28)2420(18)27h681623H910H215H3(H242728)
MFCD18181277
ZINC000044973944
ZINC000044973949
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