(4-methoxyphenyl)methyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
(4-methoxyphenyl)methyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
(4-methoxyphenyl)methyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 8008-5237 |
Compound Name: | (4-methoxyphenyl)methyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 477.31 |
Molecular Formula: | C21 H21 Br N2 O6 |
Smiles: | CC1=C(C(c2cc(c(c(c2)[Br])O)OC)NC(N1)=O)C(=O)OCc1ccc(cc1)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6414 |
logD: | 2.552 |
logSw: | -2.9385 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 87.202 |
InChI Key: | CDCQKOBNFOJGJA-SFHVURJKSA-N |