4-(4-chlorophenyl)-6-[4-(diethylamino)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-6-[4-(diethylamino)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-6-[4-(diethylamino)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0315 |
| Compound Name: | 4-(4-chlorophenyl)-6-[4-(diethylamino)anilino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 423.97 |
| Molecular Formula: | C22 H22 Cl N5 S |
| Smiles: | CCN(CC)c1ccc(cc1)Nc1c(C#N)c(c2ccc(cc2)[Cl])nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 6.1382 |
| logD: | 5.902 |
| logSw: | -6.5623 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.375 |
| InChI Key: | GVJLQSSXRUDHLR-UHFFFAOYSA-N |