4-[4-(dimethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[4-(dimethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-[4-(dimethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0077 |
| Compound Name: | 4-[4-(dimethylamino)anilino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C21 H21 N5 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(Nc2ccc(cc2)N(C)C)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 5.2463 |
| logD: | 5.2353 |
| logSw: | -5.2818 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.444 |
| InChI Key: | ZCANZAQMENVNSF-UHFFFAOYSA-N |