4-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
4-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D287-0095 |
| Compound Name: | 4-(4-methylphenyl)-6-(4-methylpiperazin-1-yl)-2-(methylsulfanyl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 339.46 |
| Molecular Formula: | C18 H21 N5 S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(nc(n1)SC)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6789 |
| logD: | 3.4083 |
| logSw: | -4.1214 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.949 |
| InChI Key: | KNVAAICJNSQAKL-UHFFFAOYSA-N |