4-(4-chlorophenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0341 |
| Compound Name: | 4-(4-chlorophenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile |
| Molecular Weight: | 403.93 |
| Molecular Formula: | C19 H22 Cl N5 O S |
| Smiles: | CSc1nc(c2ccc(cc2)[Cl])c(C#N)c(NCCCN2CCOCC2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.516 |
| logD: | 3.3468 |
| logSw: | -4.6333 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.694 |
| InChI Key: | WRGIDKHZDTWMRJ-UHFFFAOYSA-N |