2-(1H-benzimidazol-1-yl)-3-methylbut-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-1-yl)-3-methylbut-2-enenitrile
2-(1H-benzimidazol-1-yl)-3-methylbut-2-enenitrile
Compound characteristics
| Compound ID: | 0831-0918 |
| Compound Name: | 2-(1H-benzimidazol-1-yl)-3-methylbut-2-enenitrile |
| Molecular Weight: | 197.24 |
| Molecular Formula: | C12 H11 N3 |
| Smiles: | CC(C)=C(C#N)n1cnc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.4365 |
| logD: | 2.4365 |
| logSw: | -2.0326 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 27.3519 |
| InChI Key: | HRPFYNCEIAYZKT-UHFFFAOYSA-N |