3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-phenylpropyl)propanamide
Chemical Structure Depiction of
3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-phenylpropyl)propanamide
3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-phenylpropyl)propanamide
Compound characteristics
| Compound ID: | S629-0763 |
| Compound Name: | 3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-phenylpropyl)propanamide |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C22 H28 N2 O4 S |
| Smiles: | CC(CNC(CCc1ccc2c(CN(CCO2)S(C)(=O)=O)c1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1742 |
| logD: | 3.1742 |
| logSw: | -3.4471 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.857 |
| InChI Key: | MNOHADZUYJXECK-KRWDZBQOSA-N |