1-benzyl-2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
Chemical Structure Depiction of
1-benzyl-2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
1-benzyl-2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole
Compound characteristics
| Compound ID: | 5696-0012 |
| Compound Name: | 1-benzyl-2-[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-1H-benzimidazole |
| Molecular Weight: | 455.54 |
| Molecular Formula: | C25 H21 N5 O2 S |
| Smiles: | Cc1nc(c(n1Cc1ccccc1)Sc1nc2ccccc2n1Cc1ccccc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.994 |
| logD: | 5.9939 |
| logSw: | -5.6673 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.258 |
| InChI Key: | AQYWTQYCLFNZBK-UHFFFAOYSA-N |