2,4-dinitro-6-{[(2-phenyl-1H-benzimidazol-5-yl)imino]methyl}benzene-1,3-diol
Chemical Structure Depiction of
2,4-dinitro-6-{[(2-phenyl-1H-benzimidazol-5-yl)imino]methyl}benzene-1,3-diol
2,4-dinitro-6-{[(2-phenyl-1H-benzimidazol-5-yl)imino]methyl}benzene-1,3-diol
Compound characteristics
| Compound ID: | 8005-6070 |
| Compound Name: | 2,4-dinitro-6-{[(2-phenyl-1H-benzimidazol-5-yl)imino]methyl}benzene-1,3-diol |
| Molecular Weight: | 419.35 |
| Molecular Formula: | C20 H13 N5 O6 |
| Smiles: | C(\c1cc(c(c(c1O)[N+]([O-])=O)O)[N+]([O-])=O)=N/c1ccc2c(c1)nc(c1ccccc1)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 4.7002 |
| logD: | -0.365 |
| logSw: | -4.6369 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 124.204 |
| InChI Key: | CMEXZRLGVVYVFJ-UHFFFAOYSA-N |