4-(3,4-dimethylanilino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(3,4-dimethylanilino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(3,4-dimethylanilino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D287-0103 |
| Compound Name: | 4-(3,4-dimethylanilino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 360.48 |
| Molecular Formula: | C21 H20 N4 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(Nc2ccc(C)c(C)c2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 6.1437 |
| logD: | 6.1437 |
| logSw: | -5.7107 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.639 |
| InChI Key: | FJDHGJPRAMAMMP-UHFFFAOYSA-N |