(4-methylphenyl)methyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
(4-methylphenyl)methyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
(4-methylphenyl)methyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 3404-5420 |
| Compound Name: | (4-methylphenyl)methyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 397.39 |
| Molecular Formula: | C20 H19 N3 O6 |
| Smiles: | CC1=C(C(c2ccc(c(c2)[N+]([O-])=O)O)NC(N1)=O)C(=O)OCc1ccc(C)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0065 |
| logD: | 2.4452 |
| logSw: | -3.2933 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.178 |
| InChI Key: | CAXBMMDDYJGQBV-SFHVURJKSA-N |