4-chloro-N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Chemical Structure Depiction of
4-chloro-N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
4-chloro-N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide
Compound characteristics
| Compound ID: | V004-7788 |
| Compound Name: | 4-chloro-N-{4-[(4-chlorophenyl)methyl]-2-ethyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}benzamide |
| Molecular Weight: | 469.37 |
| Molecular Formula: | C25 H22 Cl2 N2 O3 |
| Smiles: | CCC1C(N(Cc2ccc(cc2)[Cl])Cc2cc(ccc2O1)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7263 |
| logD: | 5.7248 |
| logSw: | -5.9949 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.866 |
| InChI Key: | RXQULNQDDDIQBM-JOCHJYFZSA-N |