2-{[(1H-benzimidazol-2-yl)imino]methyl}-4,6-dinitrophenol
Chemical Structure Depiction of
2-{[(1H-benzimidazol-2-yl)imino]methyl}-4,6-dinitrophenol
2-{[(1H-benzimidazol-2-yl)imino]methyl}-4,6-dinitrophenol
Compound characteristics
| Compound ID: | 8005-1726 |
| Compound Name: | 2-{[(1H-benzimidazol-2-yl)imino]methyl}-4,6-dinitrophenol |
| Molecular Weight: | 327.25 |
| Molecular Formula: | C14 H9 N5 O5 |
| Smiles: | C(\c1cc(cc(c1O)[N+]([O-])=O)[N+]([O-])=O)=N/c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.9699 |
| logD: | -0.5684 |
| logSw: | -3.3077 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.732 |
| InChI Key: | BDWRRXRNIGZNQO-UHFFFAOYSA-N |