2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Compound characteristics
Compound ID: | 8003-4500 |
Compound Name: | 2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3-methylphenyl)acetamide |
Molecular Weight: | 339.41 |
Molecular Formula: | C18 H17 N3 O2 S |
Smiles: | CC(c1cc(C#N)c(nc1C)SCC(Nc1cccc(C)c1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.207 |
logD: | 3.207 |
logSw: | -3.355 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.323 |
InChI Key: | CQBOBAGKGAMOGS-UHFFFAOYSA-N |