4-(4-tert-butylphenyl)-6-(4-ethoxyanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-tert-butylphenyl)-6-(4-ethoxyanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-tert-butylphenyl)-6-(4-ethoxyanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0054 |
| Compound Name: | 4-(4-tert-butylphenyl)-6-(4-ethoxyanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | CCOc1ccc(cc1)Nc1c(C#N)c(c2ccc(cc2)C(C)(C)C)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 6.8964 |
| logD: | 6.8963 |
| logSw: | -5.9575 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.763 |
| InChI Key: | YAYODTBTXXZHFR-UHFFFAOYSA-N |