4-(3,4-dihydroquinolin-1(2H)-yl)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(3,4-dihydroquinolin-1(2H)-yl)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(3,4-dihydroquinolin-1(2H)-yl)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0372 |
| Compound Name: | 4-(3,4-dihydroquinolin-1(2H)-yl)-6-(4-methylphenyl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 372.49 |
| Molecular Formula: | C22 H20 N4 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(nc(n1)SC)N1CCCc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.8428 |
| logD: | 5.8428 |
| logSw: | -5.7758 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.137 |
| InChI Key: | BPJDRWASYBXEKH-UHFFFAOYSA-N |