5-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}-2-chlorobenzoic acid
Chemical Structure Depiction of
5-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}-2-chlorobenzoic acid
5-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}-2-chlorobenzoic acid
Compound characteristics
| Compound ID: | 8008-9116 |
| Compound Name: | 5-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}-2-chlorobenzoic acid |
| Molecular Weight: | 389.8 |
| Molecular Formula: | C21 H12 Cl N3 O3 |
| Smiles: | C(=C(C#N)/c1nc2ccccc2[nH]1)\c1ccc(c2ccc(c(c2)C(O)=O)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 5.0547 |
| logD: | 0.6244 |
| logSw: | -4.8661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.292 |
| InChI Key: | YEVARUSXZLMOCC-UHFFFAOYSA-N |