7-chloro-9-methoxy-N-(4-sulfamoylphenyl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-9-methoxy-N-(4-sulfamoylphenyl)-1-benzoxepine-4-carboxamide
7-chloro-9-methoxy-N-(4-sulfamoylphenyl)-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0622 |
| Compound Name: | 7-chloro-9-methoxy-N-(4-sulfamoylphenyl)-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 406.84 |
| Molecular Formula: | C18 H15 Cl N2 O5 S |
| Smiles: | COc1cc(cc2C=C(C=COc12)C(Nc1ccc(cc1)S(N)(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0262 |
| logD: | 3.0249 |
| logSw: | -3.6868 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.872 |
| InChI Key: | JYLISBJGPPMHJG-UHFFFAOYSA-N |