2-(3-nitrophenyl)-1H-benzimidazole-5-carboxylic acid
Chemical Structure Depiction of
2-(3-nitrophenyl)-1H-benzimidazole-5-carboxylic acid
2-(3-nitrophenyl)-1H-benzimidazole-5-carboxylic acid
Compound characteristics
| Compound ID: | 0429-0002 |
| Compound Name: | 2-(3-nitrophenyl)-1H-benzimidazole-5-carboxylic acid |
| Molecular Weight: | 283.24 |
| Molecular Formula: | C14 H9 N3 O4 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)c1nc2cc(ccc2[nH]1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4701 |
| logD: | 1.2721 |
| logSw: | -3.7974 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.048 |
| InChI Key: | SFXKPMUEOFVTTG-UHFFFAOYSA-N |