5-nitro-2-octyl-1H-benzimidazole--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-nitro-2-octyl-1H-benzimidazole--hydrogen chloride (1/1)
5-nitro-2-octyl-1H-benzimidazole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 0478-0710 |
| Compound Name: | 5-nitro-2-octyl-1H-benzimidazole--hydrogen chloride (1/1) |
| Molecular Weight: | 311.81 |
| Molecular Formula: | C15 H21 N3 O2 |
| Salt: | HCl |
| Smiles: | CCCCCCCCc1nc2cc(ccc2[nH]1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4846 |
| logD: | 5.4705 |
| logSw: | -5.3164 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.902 |
| InChI Key: | UNOMUPOSVADGHI-UHFFFAOYSA-N |