7-chloro-N-(2-ethylphenyl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-N-(2-ethylphenyl)-1-benzoxepine-4-carboxamide
7-chloro-N-(2-ethylphenyl)-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0197 |
| Compound Name: | 7-chloro-N-(2-ethylphenyl)-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 325.79 |
| Molecular Formula: | C19 H16 Cl N O2 |
| Smiles: | CCc1ccccc1NC(C1C=COc2ccc(cc2C=1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3905 |
| logD: | 5.3904 |
| logSw: | -5.8601 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.2564 |
| InChI Key: | YSBGTHHHIQJAIQ-UHFFFAOYSA-N |