6-benzyl-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
6-benzyl-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
6-benzyl-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | L521-1685 |
| Compound Name: | 6-benzyl-N-{[4-(methylsulfanyl)phenyl]methyl}-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C21 H18 N4 O2 S2 |
| Smiles: | CSc1ccc(CNC(c2c3c(C(N(Cc4ccccc4)C=N3)=O)ns2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.198 |
| logD: | 3.1938 |
| logSw: | -3.3923 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.853 |
| InChI Key: | FUVXIHFBEQPJSE-UHFFFAOYSA-N |