2-(1H-benzimidazol-2-yl)-3-(4-bromophenyl)prop-2-enenitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-(4-bromophenyl)prop-2-enenitrile--hydrogen chloride (1/1)
2-(1H-benzimidazol-2-yl)-3-(4-bromophenyl)prop-2-enenitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8007-0087 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-(4-bromophenyl)prop-2-enenitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 360.64 |
| Molecular Formula: | C16 H10 Br N3 |
| Salt: | HCl |
| Smiles: | C(=C(C#N)/c1nc2ccccc2[nH]1)\c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4862 |
| logD: | 4.4853 |
| logSw: | -4.6351 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.314 |
| InChI Key: | DZZYTIUHKWGIGD-FMIVXFBMSA-N |