4-{[2-(4-fluorophenyl)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-{[2-(4-fluorophenyl)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-{[2-(4-fluorophenyl)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0431 |
| Compound Name: | 4-{[2-(4-fluorophenyl)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C21 H19 F N4 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(NCCc2ccc(cc2)F)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 5.1117 |
| logD: | 5.1117 |
| logSw: | -5.1201 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.803 |
| InChI Key: | PPUHVAFDWCVCMF-UHFFFAOYSA-N |