4-(4-tert-butylphenyl)-6-(2-methoxy-5-methylanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-tert-butylphenyl)-6-(2-methoxy-5-methylanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-tert-butylphenyl)-6-(2-methoxy-5-methylanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0021 |
| Compound Name: | 4-(4-tert-butylphenyl)-6-(2-methoxy-5-methylanilino)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | Cc1ccc(c(c1)Nc1c(C#N)c(c2ccc(cc2)C(C)(C)C)nc(n1)SC)OC |
| Stereo: | ACHIRAL |
| logP: | 6.6812 |
| logD: | 6.6812 |
| logSw: | -5.9252 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.572 |
| InChI Key: | JLWYLLIKMYVKNA-UHFFFAOYSA-N |