2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
Chemical Structure Depiction of
2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
Compound characteristics
| Compound ID: | 5696-0004 |
| Compound Name: | 2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C18 H15 N5 O2 S |
| Smiles: | Cc1nc(c(n1Cc1ccccc1)Sc1nc2ccccc2[nH]1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7224 |
| logD: | 3.7149 |
| logSw: | -4.0679 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.761 |
| InChI Key: | FFCYAGZZQDETHY-UHFFFAOYSA-N |