3-(azepane-1-sulfonyl)-N-(4-nitrophenyl)benzamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-N-(4-nitrophenyl)benzamide
3-(azepane-1-sulfonyl)-N-(4-nitrophenyl)benzamide
Compound characteristics
| Compound ID: | 3558-0126 |
| Compound Name: | 3-(azepane-1-sulfonyl)-N-(4-nitrophenyl)benzamide |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C19 H21 N3 O5 S |
| Smiles: | C1CCCN(CC1)S(c1cccc(c1)C(Nc1ccc(cc1)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6205 |
| logD: | 3.4158 |
| logSw: | -3.8551 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.753 |
| InChI Key: | USNMBEHNENCIMH-UHFFFAOYSA-N |