7-chloro-9-methoxy-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-9-methoxy-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide
7-chloro-9-methoxy-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0665 |
| Compound Name: | 7-chloro-9-methoxy-N-[4-(morpholin-4-yl)phenyl]-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C22 H21 Cl N2 O4 |
| Smiles: | COc1cc(cc2C=C(C=COc12)C(Nc1ccc(cc1)N1CCOCC1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3846 |
| logD: | 4.3844 |
| logSw: | -4.5881 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.63 |
| InChI Key: | UEZLWMZXRXXRAR-UHFFFAOYSA-N |