3-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
3-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | C200-8576 |
| Compound Name: | 3-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C17 H17 N3 O3 S2 |
| Smiles: | CSc1ccc(CNC(CCN2C(c3c(ccs3)NC2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6366 |
| logD: | 2.636 |
| logSw: | -3.0338 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.949 |
| InChI Key: | VKOQTLFRCREVMH-UHFFFAOYSA-N |