4-(5-chloro-2-methoxyanilino)-6-(4-chlorophenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(5-chloro-2-methoxyanilino)-6-(4-chlorophenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(5-chloro-2-methoxyanilino)-6-(4-chlorophenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0348 |
| Compound Name: | 4-(5-chloro-2-methoxyanilino)-6-(4-chlorophenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 417.31 |
| Molecular Formula: | C19 H14 Cl2 N4 O S |
| Smiles: | COc1ccc(cc1Nc1c(C#N)c(c2ccc(cc2)[Cl])nc(n1)SC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.8974 |
| logD: | 5.8974 |
| logSw: | -6.4312 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.572 |
| InChI Key: | DAPFHIOFFJYKDL-UHFFFAOYSA-N |