4-[(2-hydroxyethyl)(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[(2-hydroxyethyl)(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-[(2-hydroxyethyl)(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0405 |
| Compound Name: | 4-[(2-hydroxyethyl)(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 314.41 |
| Molecular Formula: | C16 H18 N4 O S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(nc(n1)SC)N(C)CCO |
| Stereo: | ACHIRAL |
| logP: | 3.0647 |
| logD: | 3.0646 |
| logSw: | -2.8471 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.88 |
| InChI Key: | LDOGVAWIVSIUDU-UHFFFAOYSA-N |