4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[3-(methylsulfanyl)anilino]pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[3-(methylsulfanyl)anilino]pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[3-(methylsulfanyl)anilino]pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0333 |
| Compound Name: | 4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[3-(methylsulfanyl)anilino]pyrimidine-5-carbonitrile |
| Molecular Weight: | 398.93 |
| Molecular Formula: | C19 H15 Cl N4 S2 |
| Smiles: | CSc1cccc(c1)Nc1c(C#N)c(c2ccc(cc2)[Cl])nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 5.7886 |
| logD: | 5.7886 |
| logSw: | -6.4085 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.639 |
| InChI Key: | VCDSXJZARCGCCD-UHFFFAOYSA-N |