methyl 6-[(benzenesulfonyl)methyl]-4-(3-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-[(benzenesulfonyl)methyl]-4-(3-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-[(benzenesulfonyl)methyl]-4-(3-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0428 |
| Compound Name: | methyl 6-[(benzenesulfonyl)methyl]-4-(3-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 420.87 |
| Molecular Formula: | C19 H17 Cl N2 O5 S |
| Smiles: | COC(C1C(c2cccc(c2)[Cl])NC(NC=1CS(c1ccccc1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4025 |
| logD: | 1.9767 |
| logSw: | -3.1683 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.237 |
| InChI Key: | ASLJCBDYYGBMCF-KRWDZBQOSA-N |