7-chloro-9-methoxy-N-(2-phenylethyl)-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-9-methoxy-N-(2-phenylethyl)-1-benzoxepine-4-carboxamide
7-chloro-9-methoxy-N-(2-phenylethyl)-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0675 |
| Compound Name: | 7-chloro-9-methoxy-N-(2-phenylethyl)-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 355.82 |
| Molecular Formula: | C20 H18 Cl N O3 |
| Smiles: | COc1cc(cc2C=C(C=COc12)C(NCCc1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2611 |
| logD: | 4.2611 |
| logSw: | -4.5971 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.432 |
| InChI Key: | ZLPVOBRGEJQMNQ-UHFFFAOYSA-N |