4-(4-methylphenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-methylphenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile
4-(4-methylphenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0418 |
| Compound Name: | 4-(4-methylphenyl)-2-(methylsulfanyl)-6-{[3-(morpholin-4-yl)propyl]amino}pyrimidine-5-carbonitrile |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C20 H25 N5 O S |
| Smiles: | Cc1ccc(cc1)c1c(C#N)c(NCCCN2CCOCC2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 3.3446 |
| logD: | 3.1754 |
| logSw: | -3.5634 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.694 |
| InChI Key: | VJKAZDBWVCJHHD-UHFFFAOYSA-N |