7-methoxy-N-[4-(1H-tetrazol-1-yl)phenyl]-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-methoxy-N-[4-(1H-tetrazol-1-yl)phenyl]-1-benzoxepine-4-carboxamide
7-methoxy-N-[4-(1H-tetrazol-1-yl)phenyl]-1-benzoxepine-4-carboxamide
Compound characteristics
| Compound ID: | D443-0819 |
| Compound Name: | 7-methoxy-N-[4-(1H-tetrazol-1-yl)phenyl]-1-benzoxepine-4-carboxamide |
| Molecular Weight: | 361.36 |
| Molecular Formula: | C19 H15 N5 O3 |
| Smiles: | COc1ccc2c(C=C(C=CO2)C(Nc2ccc(cc2)n2cnnn2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.3433 |
| logD: | 3.3433 |
| logSw: | -3.768 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.263 |
| InChI Key: | YVHXZCLEIRDVKL-UHFFFAOYSA-N |