{2-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid
Chemical Structure Depiction of
{2-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid
{2-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetic acid
Compound characteristics
| Compound ID: | 6025-5616 |
| Compound Name: | {2-[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)Oc1ccccc1/C=C(C#N)/c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.189 |
| logD: | -1.048 |
| logSw: | -3.4554 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.284 |
| InChI Key: | GCFUPKXQYKBDFB-UHFFFAOYSA-N |