3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(3-phenylpropyl)propanamide
Chemical Structure Depiction of
3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(3-phenylpropyl)propanamide
3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(3-phenylpropyl)propanamide
Compound characteristics
| Compound ID: | S629-0670 |
| Compound Name: | 3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(3-phenylpropyl)propanamide |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C22 H28 N2 O4 S |
| Smiles: | CS(N1CCOc2ccc(CCC(NCCCc3ccccc3)=O)cc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0808 |
| logD: | 3.0808 |
| logSw: | -3.4887 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.699 |
| InChI Key: | UZQRLRVRYGNIIG-UHFFFAOYSA-N |