4-(3,4-dihydroquinolin-1(2H)-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(3,4-dihydroquinolin-1(2H)-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
4-(3,4-dihydroquinolin-1(2H)-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0258 |
| Compound Name: | 4-(3,4-dihydroquinolin-1(2H)-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C21 H18 N4 S |
| Smiles: | CSc1nc(c2ccccc2)c(C#N)c(n1)N1CCCc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.3143 |
| logD: | 5.3143 |
| logSw: | -5.5223 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.137 |
| InChI Key: | JKNVIYDBYUBJRM-UHFFFAOYSA-N |