N-(4-acetamidophenyl)-7-chloro-9-methoxy-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-7-chloro-9-methoxy-1-benzoxepine-4-carboxamide
N-(4-acetamidophenyl)-7-chloro-9-methoxy-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0636 |
| Compound Name: | N-(4-acetamidophenyl)-7-chloro-9-methoxy-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 384.82 |
| Molecular Formula: | C20 H17 Cl N2 O4 |
| Smiles: | CC(Nc1ccc(cc1)NC(C1C=COc2c(C=1)cc(cc2OC)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8669 |
| logD: | 3.8668 |
| logSw: | -4.3329 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.531 |
| InChI Key: | HBJNYZYLMUBKBY-UHFFFAOYSA-N |