4-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0291 |
| Compound Name: | 4-(4-chlorophenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 359.88 |
| Molecular Formula: | C17 H18 Cl N5 S |
| Smiles: | CN1CCN(CC1)c1c(C#N)c(c2ccc(cc2)[Cl])nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 3.8503 |
| logD: | 3.5796 |
| logSw: | -4.8572 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.949 |
| InChI Key: | SNQUHFUELZWDRJ-UHFFFAOYSA-N |