4-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
4-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0212 |
| Compound Name: | 4-[4-(4-methylpiperidin-1-yl)anilino]-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 415.56 |
| Molecular Formula: | C24 H25 N5 S |
| Smiles: | CC1CCN(CC1)c1ccc(cc1)Nc1c(C#N)c(c2ccccc2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 5.8359 |
| logD: | 5.8147 |
| logSw: | -5.8775 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.091 |
| InChI Key: | XBFUOWSEQBVMOI-UHFFFAOYSA-N |