4-[4-(diethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[4-(diethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-[4-(diethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0393 |
| Compound Name: | 4-[4-(diethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 403.55 |
| Molecular Formula: | C23 H25 N5 S |
| Smiles: | CCN(CC)c1ccc(cc1)Nc1c(C#N)c(c2ccc(C)cc2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 5.9668 |
| logD: | 5.7306 |
| logSw: | -5.7951 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.375 |
| InChI Key: | CIIUXNXZWYJMRL-UHFFFAOYSA-N |