N-{[4-(methylsulfanyl)phenyl]methyl}-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide
N-{[4-(methylsulfanyl)phenyl]methyl}-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide
Compound characteristics
| Compound ID: | C207-0081 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C18 H18 N2 O3 S |
| Smiles: | CSc1ccc(CNC(CCN2C(=O)Oc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0605 |
| logD: | 3.0605 |
| logSw: | -3.608 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.517 |
| InChI Key: | QXRSABFBNLJGDA-UHFFFAOYSA-N |