{4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid
Chemical Structure Depiction of
{4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid
{4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid
Compound characteristics
| Compound ID: | 8007-8323 |
| Compound Name: | {4-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid |
| Molecular Weight: | 319.32 |
| Molecular Formula: | C18 H13 N3 O3 |
| Smiles: | C(C(O)=O)Oc1ccc(/C=C(C#N)/c2nc3ccccc3[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.942 |
| logD: | -1.295 |
| logSw: | -3.3339 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.197 |
| InChI Key: | VKCPAXOWUFCKTN-UHFFFAOYSA-N |