2-({[4-(5-amino-1H-benzimidazol-2-yl)phenyl]imino}methyl)-4,6-dinitrophenol
Chemical Structure Depiction of
2-({[4-(5-amino-1H-benzimidazol-2-yl)phenyl]imino}methyl)-4,6-dinitrophenol
2-({[4-(5-amino-1H-benzimidazol-2-yl)phenyl]imino}methyl)-4,6-dinitrophenol
Compound characteristics
| Compound ID: | 8004-2000 |
| Compound Name: | 2-({[4-(5-amino-1H-benzimidazol-2-yl)phenyl]imino}methyl)-4,6-dinitrophenol |
| Molecular Weight: | 418.37 |
| Molecular Formula: | C20 H14 N6 O5 |
| Smiles: | C(\c1cc(cc(c1O)[N+]([O-])=O)[N+]([O-])=O)=N/c1ccc(cc1)c1nc2cc(ccc2[nH]1)N |
| Stereo: | ACHIRAL |
| logP: | 3.7908 |
| logD: | -1.0365 |
| logSw: | -4.2128 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 130.133 |
| InChI Key: | NSLQOQMSEMKKBE-UHFFFAOYSA-N |