4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile
4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D287-0092 |
| Compound Name: | 4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-(pyrrolidin-1-yl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 352.5 |
| Molecular Formula: | C20 H24 N4 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1c(C#N)c(nc(n1)SC)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.8153 |
| logD: | 5.8153 |
| logSw: | -5.7624 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.838 |
| InChI Key: | PPWSPEDVKFUQQS-UHFFFAOYSA-N |