3-{4-[(2,3-dimethoxyphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
Chemical Structure Depiction of
3-{4-[(2,3-dimethoxyphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
3-{4-[(2,3-dimethoxyphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide
Compound characteristics
| Compound ID: | S629-1167 |
| Compound Name: | 3-{4-[(2,3-dimethoxyphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N,N-dimethylpropanamide |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C23 H30 N2 O4 |
| Smiles: | CN(C)C(CCc1ccc2c(CN(CCO2)Cc2cccc(c2OC)OC)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7997 |
| logD: | 0.2894 |
| logSw: | -3.0763 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.736 |
| InChI Key: | BKCSBDLQZNXPFS-UHFFFAOYSA-N |