2-(6-methyl-1H-benzimidazol-2-yl)-3-[4-(methylsulfanyl)phenyl]prop-2-enenitrile
Chemical Structure Depiction of
2-(6-methyl-1H-benzimidazol-2-yl)-3-[4-(methylsulfanyl)phenyl]prop-2-enenitrile
2-(6-methyl-1H-benzimidazol-2-yl)-3-[4-(methylsulfanyl)phenyl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 2038-0291 |
| Compound Name: | 2-(6-methyl-1H-benzimidazol-2-yl)-3-[4-(methylsulfanyl)phenyl]prop-2-enenitrile |
| Molecular Weight: | 305.4 |
| Molecular Formula: | C18 H15 N3 S |
| Smiles: | Cc1ccc2c(c1)[nH]c(/C(=C/c1ccc(cc1)SC)C#N)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.8846 |
| logD: | 4.8826 |
| logSw: | -4.6904 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.314 |
| InChI Key: | BMZCBDAQMBKVEQ-UHFFFAOYSA-N |