4-(ethylsulfanyl)-N-[4-(2-methylpiperidine-1-sulfonyl)phenyl]-3-nitrobenzamide
Chemical Structure Depiction of
4-(ethylsulfanyl)-N-[4-(2-methylpiperidine-1-sulfonyl)phenyl]-3-nitrobenzamide
4-(ethylsulfanyl)-N-[4-(2-methylpiperidine-1-sulfonyl)phenyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8010-2909 |
| Compound Name: | 4-(ethylsulfanyl)-N-[4-(2-methylpiperidine-1-sulfonyl)phenyl]-3-nitrobenzamide |
| Molecular Weight: | 463.57 |
| Molecular Formula: | C21 H25 N3 O5 S2 |
| Smiles: | CCSc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(cc1)S(N1CCCCC1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4717 |
| logD: | 4.3107 |
| logSw: | -4.3282 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.183 |
| InChI Key: | VCVFJQQMIMNPBY-HNNXBMFYSA-N |