4-[butyl(methyl)amino]-6-(4-tert-butylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[butyl(methyl)amino]-6-(4-tert-butylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-[butyl(methyl)amino]-6-(4-tert-butylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0014 |
| Compound Name: | 4-[butyl(methyl)amino]-6-(4-tert-butylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 368.54 |
| Molecular Formula: | C21 H28 N4 S |
| Smiles: | CCCCN(C)c1c(C#N)c(c2ccc(cc2)C(C)(C)C)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 6.164 |
| logD: | 6.164 |
| logSw: | -5.6413 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.224 |
| InChI Key: | RTPTYLUEIJTMCP-UHFFFAOYSA-N |