4-(4-chlorophenyl)-6-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-6-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-6-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0292 |
| Compound Name: | 4-(4-chlorophenyl)-6-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 373.91 |
| Molecular Formula: | C18 H20 Cl N5 S |
| Smiles: | CCN1CCN(CC1)c1c(C#N)c(c2ccc(cc2)[Cl])nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.195 |
| logD: | 3.8462 |
| logSw: | -4.7666 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.009 |
| InChI Key: | DOJKIXKUXJNRGJ-UHFFFAOYSA-N |