1-(3,4-dimethylbenzene-1-sulfonyl)-5-nitro-1H-benzimidazole
Chemical Structure Depiction of
1-(3,4-dimethylbenzene-1-sulfonyl)-5-nitro-1H-benzimidazole
1-(3,4-dimethylbenzene-1-sulfonyl)-5-nitro-1H-benzimidazole
Compound characteristics
| Compound ID: | 2134-0103 |
| Compound Name: | 1-(3,4-dimethylbenzene-1-sulfonyl)-5-nitro-1H-benzimidazole |
| Molecular Weight: | 331.35 |
| Molecular Formula: | C15 H13 N3 O4 S |
| Smiles: | Cc1ccc(cc1C)S(n1cnc2cc(ccc12)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6185 |
| logD: | 3.6185 |
| logSw: | -3.8055 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.065 |
| InChI Key: | PCBUKBMZHNZWFM-UHFFFAOYSA-N |