4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoic acid
Chemical Structure Depiction of
4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoic acid
4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoic acid
Compound characteristics
| Compound ID: | 3229-2429 |
| Compound Name: | 4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoic acid |
| Molecular Weight: | 355.35 |
| Molecular Formula: | C21 H13 N3 O3 |
| Smiles: | C(=C(C#N)/c1nc2ccccc2[nH]1)\c1ccc(c2ccc(cc2)C(O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.6898 |
| logD: | 0.962 |
| logSw: | -4.6514 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.292 |
| InChI Key: | AHBIRSCEARQARK-UHFFFAOYSA-N |