5-nitro-2-(4-nitrophenyl)-1H-benzimidazole
Chemical Structure Depiction of
5-nitro-2-(4-nitrophenyl)-1H-benzimidazole
5-nitro-2-(4-nitrophenyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | 0109-0036 |
| Compound Name: | 5-nitro-2-(4-nitrophenyl)-1H-benzimidazole |
| Molecular Weight: | 284.23 |
| Molecular Formula: | C13 H8 N4 O4 |
| Smiles: | c1cc(ccc1c1nc2cc(ccc2[nH]1)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4955 |
| logD: | 3.3181 |
| logSw: | -3.8649 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.021 |
| InChI Key: | XJIPBORERCFIIP-UHFFFAOYSA-N |