2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
| Compound ID: | K653-0764 |
| Compound Name: | 2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide |
| Molecular Weight: | 566.53 |
| Molecular Formula: | C23 H17 F3 N4 O6 S2 |
| Smiles: | Cc1ccc(cc1S(n1c2ccccc2nc1SCC(Nc1ccc(cc1)OC(F)(F)F)=O)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1364 |
| logD: | 6.1364 |
| logSw: | -5.3879 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.332 |
| InChI Key: | DDSDGMMXWQZMBE-UHFFFAOYSA-N |