4-(tert-butylamino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(tert-butylamino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(tert-butylamino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
Compound ID: | D490-0413 |
Compound Name: | 4-(tert-butylamino)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
Molecular Weight: | 312.43 |
Molecular Formula: | C17 H20 N4 S |
Smiles: | Cc1ccc(cc1)c1c(C#N)c(NC(C)(C)C)nc(n1)SC |
Stereo: | ACHIRAL |
logP: | 4.6956 |
logD: | 4.6956 |
logSw: | -4.5445 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.056 |
InChI Key: | WGMBNBAVQGBDSK-UHFFFAOYSA-N |