3-(3,5-dibromo-4-hydroxyphenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-(3,5-dibromo-4-hydroxyphenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-(3,5-dibromo-4-hydroxyphenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 1809-0160 |
| Compound Name: | 3-(3,5-dibromo-4-hydroxyphenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 433.1 |
| Molecular Formula: | C17 H11 Br2 N3 O |
| Smiles: | Cc1ccc2c(c1)nc(/C(=C/c1cc(c(c(c1)[Br])O)[Br])C#N)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 4.8164 |
| logD: | 4.3963 |
| logSw: | -4.4326 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.793 |
| InChI Key: | HIRJMXWOSAUHGW-UHFFFAOYSA-N |