3-{4-[(azepan-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
Chemical Structure Depiction of
3-{4-[(azepan-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
3-{4-[(azepan-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
Compound characteristics
| Compound ID: | S629-1152 |
| Compound Name: | 3-{4-[(azepan-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C22 H33 N3 O3 |
| Smiles: | CN(C)C(CCc1ccc2c(CN(CCO2)C(CN2CCCCCC2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9078 |
| logD: | 1.7694 |
| logSw: | -2.4387 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.112 |
| InChI Key: | AIKASNKMOWMLSS-UHFFFAOYSA-N |