3-[3-(4-fluorophenyl)-7-oxo[1,2]oxazolo[4,5-d]pyrimidin-6(7H)-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[3-(4-fluorophenyl)-7-oxo[1,2]oxazolo[4,5-d]pyrimidin-6(7H)-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
3-[3-(4-fluorophenyl)-7-oxo[1,2]oxazolo[4,5-d]pyrimidin-6(7H)-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | L429-1014 |
| Compound Name: | 3-[3-(4-fluorophenyl)-7-oxo[1,2]oxazolo[4,5-d]pyrimidin-6(7H)-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C22 H19 F N4 O3 S |
| Smiles: | CSc1ccc(CNC(CCN2C=Nc3c(c4ccc(cc4)F)noc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9671 |
| logD: | 2.9671 |
| logSw: | -3.393 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.697 |
| InChI Key: | UAVJCJUIXRQSCY-UHFFFAOYSA-N |