N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(4-oxo-3-phenyl[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl)propanamide
Chemical Structure Depiction of
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(4-oxo-3-phenyl[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl)propanamide
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(4-oxo-3-phenyl[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl)propanamide
Compound characteristics
| Compound ID: | E898-2162 |
| Compound Name: | N-{2-[4-(methylsulfanyl)phenyl]ethyl}-3-(4-oxo-3-phenyl[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl)propanamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | CSc1ccc(CCNC(CCN2C=Nc3c(C2=O)c(c2ccccc2)no3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4656 |
| logD: | 2.4656 |
| logSw: | -2.7501 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.993 |
| InChI Key: | QTLRPCYAHDSHMT-UHFFFAOYSA-N |