5-nitro-2-(pyridin-3-yl)-1H-benzimidazole--sulfuric acid (1/1)
Chemical Structure Depiction of
5-nitro-2-(pyridin-3-yl)-1H-benzimidazole--sulfuric acid (1/1)
5-nitro-2-(pyridin-3-yl)-1H-benzimidazole--sulfuric acid (1/1)
Compound characteristics
Compound ID: | 8005-4443 |
Compound Name: | 5-nitro-2-(pyridin-3-yl)-1H-benzimidazole--sulfuric acid (1/1) |
Molecular Weight: | 338.3 |
Molecular Formula: | C12 H8 N4 O2 |
Salt: | H2SO4 |
Smiles: | c1cc(cnc1)c1nc2cc(ccc2[nH]1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.1926 |
logD: | 2.1051 |
logSw: | -2.2401 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.157 |
InChI Key: | IIIXDDOCSBCSNQ-UHFFFAOYSA-N |