N-(4-nitrophenyl)azepane-1-carboxamide
Chemical Structure Depiction of
N-(4-nitrophenyl)azepane-1-carboxamide
N-(4-nitrophenyl)azepane-1-carboxamide
Compound characteristics
| Compound ID: | Y205-2340 |
| Compound Name: | N-(4-nitrophenyl)azepane-1-carboxamide |
| Molecular Weight: | 263.29 |
| Molecular Formula: | C13 H17 N3 O3 |
| Smiles: | C1CCCN(CC1)C(Nc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8838 |
| logD: | 2.8837 |
| logSw: | -3.463 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.42 |
| InChI Key: | YYOHHSLXMDWRGO-UHFFFAOYSA-N |