4-[benzyl(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-[benzyl(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-[benzyl(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0379 |
| Compound Name: | 4-[benzyl(methyl)amino]-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 360.48 |
| Molecular Formula: | C21 H20 N4 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(nc(n1)SC)N(C)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3841 |
| logD: | 5.384 |
| logSw: | -5.6386 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.974 |
| InChI Key: | WRQWKBILPPXOEO-UHFFFAOYSA-N |