N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3057-0976 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 324.34 |
| Molecular Formula: | C17 H16 N4 O3 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(NCCc1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8462 |
| logD: | 2.8456 |
| logSw: | -3.3747 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.855 |
| InChI Key: | JPRUSVVGPCANJQ-UHFFFAOYSA-N |