3-nitro-N-{4-[6-(3-nitrobenzamido)-1H-benzimidazol-2-yl]phenyl}benzamide
Chemical Structure Depiction of
3-nitro-N-{4-[6-(3-nitrobenzamido)-1H-benzimidazol-2-yl]phenyl}benzamide
3-nitro-N-{4-[6-(3-nitrobenzamido)-1H-benzimidazol-2-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | K806-0034 |
| Compound Name: | 3-nitro-N-{4-[6-(3-nitrobenzamido)-1H-benzimidazol-2-yl]phenyl}benzamide |
| Molecular Weight: | 522.48 |
| Molecular Formula: | C27 H18 N6 O6 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)C(Nc1ccc(cc1)c1nc2ccc(cc2[nH]1)NC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3362 |
| logD: | 5.3215 |
| logSw: | -5.8128 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 132.203 |
| InChI Key: | BPERJFCAQODQKA-UHFFFAOYSA-N |