2-(1H-benzimidazol-2-yl)-3-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 5609-0325 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]prop-2-enenitrile |
| Molecular Weight: | 386.37 |
| Molecular Formula: | C21 H14 N4 O4 |
| Smiles: | COc1ccc(cc1c1ccc(/C=C(C#N)/c2nc3ccccc3[nH]2)o1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4714 |
| logD: | 4.4708 |
| logSw: | -4.5596 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.896 |
| InChI Key: | XOYMRWXRRCGQKP-UHFFFAOYSA-N |