2-(1H-benzimidazol-2-yl)-3-[3-bromo-4-(dimethylamino)phenyl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[3-bromo-4-(dimethylamino)phenyl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[3-bromo-4-(dimethylamino)phenyl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 1809-0127 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[3-bromo-4-(dimethylamino)phenyl]prop-2-enenitrile |
| Molecular Weight: | 367.25 |
| Molecular Formula: | C18 H15 Br N4 |
| Smiles: | CN(C)c1ccc(/C=C(C#N)/c2nc3ccccc3[nH]2)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.3497 |
| logD: | 4.3488 |
| logSw: | -4.3943 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.818 |
| InChI Key: | ZFFDVFGGHZHMBA-UHFFFAOYSA-N |