7-chloro-9-methoxy-N-[(2-methoxyphenyl)methyl]-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-9-methoxy-N-[(2-methoxyphenyl)methyl]-1-benzoxepine-4-carboxamide
7-chloro-9-methoxy-N-[(2-methoxyphenyl)methyl]-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0715 |
| Compound Name: | 7-chloro-9-methoxy-N-[(2-methoxyphenyl)methyl]-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 371.82 |
| Molecular Formula: | C20 H18 Cl N O4 |
| Smiles: | COc1ccccc1CNC(C1C=COc2c(C=1)cc(cc2OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5489 |
| logD: | 4.5489 |
| logSw: | -4.6949 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.222 |
| InChI Key: | GQJDNCUKXQPHMI-UHFFFAOYSA-N |