methyl 4-(3,4-dimethoxyphenyl)-6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-(3,4-dimethoxyphenyl)-6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-(3,4-dimethoxyphenyl)-6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C200-5124 |
| Compound Name: | methyl 4-(3,4-dimethoxyphenyl)-6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 502.59 |
| Molecular Formula: | C25 H30 N2 O7 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(CC1=C(C(c2ccc(c(c2)OC)OC)NC(N1)=O)C(=O)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3276 |
| logD: | 2.9018 |
| logSw: | -3.766 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.498 |
| InChI Key: | FTHIMTSPXXQPFO-HSZRJFAPSA-N |