N-cyclopropyl-3-[4-(ethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
N-cyclopropyl-3-[4-(ethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
N-cyclopropyl-3-[4-(ethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1887 |
| Compound Name: | N-cyclopropyl-3-[4-(ethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 352.45 |
| Molecular Formula: | C17 H24 N2 O4 S |
| Smiles: | CCS(N1CCOc2ccc(CCC(NC3CC3)=O)cc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6652 |
| logD: | 1.6652 |
| logSw: | -2.693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.316 |
| InChI Key: | JDNGBTOOONEMMM-UHFFFAOYSA-N |