4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0396 |
| Compound Name: | 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C23 H22 F N5 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(nc(n1)SC)N1CCN(CC1)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.6468 |
| logD: | 5.6468 |
| logSw: | -5.764 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.733 |
| InChI Key: | HYDKDBAFQVMUDF-UHFFFAOYSA-N |