propan-2-yl 4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoate
Chemical Structure Depiction of
propan-2-yl 4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoate
propan-2-yl 4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 2237-1879 |
| Compound Name: | propan-2-yl 4-{5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoate |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C24 H19 N3 O3 |
| Smiles: | CC(C)OC(c1ccc(cc1)c1ccc(/C=C(C#N)/c2nc3ccccc3[nH]2)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5372 |
| logD: | 5.5366 |
| logSw: | -5.6085 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.317 |
| InChI Key: | OOQSQUPUBWADDP-UHFFFAOYSA-N |