4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[(2-phenylethyl)amino]pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[(2-phenylethyl)amino]pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[(2-phenylethyl)amino]pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D287-0139 |
| Compound Name: | 4-(4-chlorophenyl)-2-(methylsulfanyl)-6-[(2-phenylethyl)amino]pyrimidine-5-carbonitrile |
| Molecular Weight: | 380.9 |
| Molecular Formula: | C20 H17 Cl N4 S |
| Smiles: | CSc1nc(c2ccc(cc2)[Cl])c(C#N)c(NCCc2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.254 |
| logD: | 5.254 |
| logSw: | -6.0039 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.803 |
| InChI Key: | HLEBLJTUZANGDX-UHFFFAOYSA-N |