4-(2-chlorobenzene-1-sulfonyl)-N-[2-(methylsulfanyl)phenyl]-3-nitrobenzamide
Chemical Structure Depiction of
4-(2-chlorobenzene-1-sulfonyl)-N-[2-(methylsulfanyl)phenyl]-3-nitrobenzamide
4-(2-chlorobenzene-1-sulfonyl)-N-[2-(methylsulfanyl)phenyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-2794 |
| Compound Name: | 4-(2-chlorobenzene-1-sulfonyl)-N-[2-(methylsulfanyl)phenyl]-3-nitrobenzamide |
| Molecular Weight: | 462.93 |
| Molecular Formula: | C20 H15 Cl N2 O5 S2 |
| Smiles: | CSc1ccccc1NC(c1ccc(c(c1)[N+]([O-])=O)S(c1ccccc1[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2804 |
| logD: | 4.2748 |
| logSw: | -4.4878 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.213 |
| InChI Key: | QJBAGAHZUIOUBD-UHFFFAOYSA-N |