2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 8007-0095 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile |
| Molecular Weight: | 275.31 |
| Molecular Formula: | C17 H13 N3 O |
| Smiles: | COc1ccc(\C=C(C#N)/c2nc3ccccc3[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6347 |
| logD: | 3.6338 |
| logSw: | -3.9976 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.858 |
| InChI Key: | HXEYXRLBHNWGHQ-UHFFFAOYSA-N |