4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide
Chemical Structure Depiction of
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide
Compound characteristics
| Compound ID: | E015-0259 |
| Compound Name: | 4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-oxo-N-[3-(propylsulfanyl)propyl]butanamide |
| Molecular Weight: | 384.92 |
| Molecular Formula: | C18 H25 Cl N2 O3 S |
| Smiles: | CCCSCCCNC(CCC(N1CCOc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4262 |
| logD: | 2.4262 |
| logSw: | -3.4147 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.56 |
| InChI Key: | KKNFMXMCJGLTQJ-UHFFFAOYSA-N |