N-[4-(azepane-1-sulfonyl)phenyl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[4-(azepane-1-sulfonyl)phenyl]-2-nitrobenzamide
N-[4-(azepane-1-sulfonyl)phenyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | 3564-4107 |
| Compound Name: | N-[4-(azepane-1-sulfonyl)phenyl]-2-nitrobenzamide |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C19 H21 N3 O5 S |
| Smiles: | C1CCCN(CC1)S(c1ccc(cc1)NC(c1ccccc1[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3028 |
| logD: | 2.1873 |
| logSw: | -4.1186 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.452 |
| InChI Key: | RRJHKKICOQUMSI-UHFFFAOYSA-N |