3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
Chemical Structure Depiction of
3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
Compound characteristics
| Compound ID: | S629-1040 |
| Compound Name: | 3-{4-[(3-methoxyphenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C23 H28 N2 O4 |
| Smiles: | CN(C)C(CCc1ccc2c(CN(CCO2)C(Cc2cccc(c2)OC)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7021 |
| logD: | 2.7021 |
| logSw: | -2.8486 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.32 |
| InChI Key: | XSFQQDOAKXWEGS-UHFFFAOYSA-N |