4-(4-methylphenyl)-6-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-methylphenyl)-6-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-methylphenyl)-6-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0406 |
| Compound Name: | 4-(4-methylphenyl)-6-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 429.59 |
| Molecular Formula: | C25 H27 N5 S |
| Smiles: | CC1CCN(CC1)c1ccc(cc1)Nc1c(C#N)c(c2ccc(C)cc2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 6.3643 |
| logD: | 6.3432 |
| logSw: | -5.8347 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.091 |
| InChI Key: | UWDIFQBVGFSBRU-UHFFFAOYSA-N |