7-chloro-N-cyclohexyl-9-methoxy-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-chloro-N-cyclohexyl-9-methoxy-1-benzoxepine-4-carboxamide
7-chloro-N-cyclohexyl-9-methoxy-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0655 |
| Compound Name: | 7-chloro-N-cyclohexyl-9-methoxy-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 333.81 |
| Molecular Formula: | C18 H20 Cl N O3 |
| Smiles: | COc1cc(cc2C=C(C=COc12)C(NC1CCCCC1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6867 |
| logD: | 4.6867 |
| logSw: | -4.7868 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.316 |
| InChI Key: | XRJFWELPWNLVKM-UHFFFAOYSA-N |