4-{[2-(dimethylamino)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-{[2-(dimethylamino)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-{[2-(dimethylamino)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0368 |
| Compound Name: | 4-{[2-(dimethylamino)ethyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 327.45 |
| Molecular Formula: | C17 H21 N5 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(NCCN(C)C)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 3.4849 |
| logD: | 2.4968 |
| logSw: | -3.819 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.94 |
| InChI Key: | UCUFHMAAJOSSHT-UHFFFAOYSA-N |