2-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
Chemical Structure Depiction of
2-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
2-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
Compound characteristics
| Compound ID: | 8008-5948 |
| Compound Name: | 2-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole |
| Molecular Weight: | 275.29 |
| Molecular Formula: | C11 H9 N5 O2 S |
| Smiles: | Cn1cnc(c1Sc1nc2ccccc2[nH]1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6865 |
| logD: | 1.6801 |
| logSw: | -2.119 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.067 |
| InChI Key: | FSUBLVKGNQIAEM-UHFFFAOYSA-N |