4-{[(2-methoxyphenyl)methyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-{[(2-methoxyphenyl)methyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-{[(2-methoxyphenyl)methyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0399 |
| Compound Name: | 4-{[(2-methoxyphenyl)methyl]amino}-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C21 H20 N4 O S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(NCc2ccccc2OC)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.9474 |
| logD: | 4.9474 |
| logSw: | -4.8098 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.591 |
| InChI Key: | ITFCOWJRIBMQJU-UHFFFAOYSA-N |