4-(4-tert-butylphenyl)-6-[(2-methylcyclohexyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-tert-butylphenyl)-6-[(2-methylcyclohexyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-tert-butylphenyl)-6-[(2-methylcyclohexyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0107 |
| Compound Name: | 4-(4-tert-butylphenyl)-6-[(2-methylcyclohexyl)amino]-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 394.58 |
| Molecular Formula: | C23 H30 N4 S |
| Smiles: | CC1CCCCC1Nc1c(C#N)c(c2ccc(cc2)C(C)(C)C)nc(n1)SC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.9545 |
| logD: | 6.9545 |
| logSw: | -5.9736 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.076 |
| InChI Key: | SIQKRTXMYGQOET-UHFFFAOYSA-N |