7-chloro-N-(4-fluorophenyl)-9-methoxy-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-N-(4-fluorophenyl)-9-methoxy-1-benzoxepine-4-carboxamide
7-chloro-N-(4-fluorophenyl)-9-methoxy-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0600 |
| Compound Name: | 7-chloro-N-(4-fluorophenyl)-9-methoxy-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 345.76 |
| Molecular Formula: | C18 H13 Cl F N O3 |
| Smiles: | COc1cc(cc2C=C(C=COc12)C(Nc1ccc(cc1)F)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6947 |
| logD: | 4.6944 |
| logSw: | -4.8758 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.269 |
| InChI Key: | CFCPLBRYUSPSEA-UHFFFAOYSA-N |