3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 8018-1219 |
| Compound Name: | 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 353.81 |
| Molecular Formula: | C19 H16 Cl N3 O2 |
| Smiles: | Cc1cc2c(cc1C)[nH]c(/C(=C/c1cc(c(c(c1)[Cl])O)OC)C#N)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.1679 |
| logD: | 5.095 |
| logSw: | -5.3012 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.424 |
| InChI Key: | MZLYPNBWHGVVIB-UHFFFAOYSA-N |