2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | K653-0688 |
| Compound Name: | 2-{[1-(2-methyl-5-nitrobenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 524.62 |
| Molecular Formula: | C25 H24 N4 O5 S2 |
| Smiles: | CC(C)c1ccc(cc1)NC(CSc1nc2ccccc2n1S(c1cc(ccc1C)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2833 |
| logD: | 6.2833 |
| logSw: | -5.401 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.395 |
| InChI Key: | YVDWPDHMBJCALW-UHFFFAOYSA-N |