3-[3-(3,5-difluorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-[3-(3,5-difluorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-[3-(3,5-difluorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | E898-2442 |
| Compound Name: | 3-[3-(3,5-difluorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide |
| Molecular Weight: | 470.5 |
| Molecular Formula: | C23 H20 F2 N4 O3 S |
| Smiles: | CSc1ccc(CCNC(CCN2C=Nc3c(C2=O)c(c2cc(cc(c2)F)F)no3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0702 |
| logD: | 3.0701 |
| logSw: | -3.3873 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.993 |
| InChI Key: | SAMUIEOQDWILLY-UHFFFAOYSA-N |