4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide
Chemical Structure Depiction of
4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide
4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide
Compound characteristics
| Compound ID: | E015-1779 |
| Compound Name: | 4-(2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide |
| Molecular Weight: | 350.48 |
| Molecular Formula: | C18 H26 N2 O3 S |
| Smiles: | CCCSCCCNC(CCC(N1CCOc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8108 |
| logD: | 1.8108 |
| logSw: | -2.3132 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.56 |
| InChI Key: | IZPOZDAFECNWSA-UHFFFAOYSA-N |