2-(azepan-1-yl)-N-(4-ethylphenyl)-5-nitrobenzamide
Chemical Structure Depiction of
2-(azepan-1-yl)-N-(4-ethylphenyl)-5-nitrobenzamide
2-(azepan-1-yl)-N-(4-ethylphenyl)-5-nitrobenzamide
Compound characteristics
| Compound ID: | 8013-5724 |
| Compound Name: | 2-(azepan-1-yl)-N-(4-ethylphenyl)-5-nitrobenzamide |
| Molecular Weight: | 367.45 |
| Molecular Formula: | C21 H25 N3 O3 |
| Smiles: | CCc1ccc(cc1)NC(c1cc(ccc1N1CCCCCC1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.357 |
| logD: | 5.3546 |
| logSw: | -5.2661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.194 |
| InChI Key: | IRJLOMJIIDVOPE-UHFFFAOYSA-N |