methyl 4-(4-chlorophenyl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-(4-chlorophenyl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-(4-chlorophenyl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8020-4443 |
| Compound Name: | methyl 4-(4-chlorophenyl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 410.9 |
| Molecular Formula: | C16 H15 Cl N4 O3 S2 |
| Smiles: | Cc1nnc(SCC2=C(C(c3ccc(cc3)[Cl])NC(N2)=O)C(=O)OC)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4055 |
| logD: | 2.197 |
| logSw: | -3.4777 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.872 |
| InChI Key: | OAMPSUUABWABLH-ZDUSSCGKSA-N |