methyl 6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0297 |
| Compound Name: | methyl 6-{[4-(2-methylpropyl)benzene-1-sulfonyl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 442.53 |
| Molecular Formula: | C23 H26 N2 O5 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(CC1=C(C(c2ccccc2)NC(N1)=O)C(=O)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5706 |
| logD: | 3.1449 |
| logSw: | -3.786 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.237 |
| InChI Key: | DUOBJICVWQYKIZ-OAQYLSRUSA-N |