1589081-28-6

Basic information

• Product Name: 4-amino-6-(benzo[d][1,3]dioxol-5-yl)-2-((2-phenylthiazol-4-yl)methylthio)pyrimidine-5-carbonitrile
• CAS NO: 1589081-28-6
• Molecular Weight: 445.525
• Mol File: 1589081-28-6.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 4-amino-6-(benzo[d][1,3]dioxol-5-yl)-2-((2-phenylthiazol-4-yl)methylthio)pyrimidine-5-carbonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 4-amino-6-(benzo[d][1,3]dioxol-5-yl)-2-((2-phenylthiazol-4-yl)methylthio)pyrimidine-5-carbonitrile(1589081-28-6)
• EPA Substance Registry System: 4-amino-6-(benzo[d][1,3]dioxol-5-yl)-2-((2-phenylthiazol-4-yl)methylthio)pyrimidine-5-carbonitrile(1589081-28-6)

Safety Data

• Hazardous Substances Data: 1589081-28-6(Hazardous Substances Data)

Upstream product

• 26060-30-0 4-nitrothiobenzamide 
• 4771-32-8 4-chloromethyl-2-(4-nitrophenyl)-thiazole 
• 1589080-67-0 4-amino-6-(benzo[d][1,3]dioxol-5-yl)-2-mercaptopyrimidine-5-carbonitrile 
• 120-57-0 piperonal 
• 619-72-7 4-nitrobenzonitrile 

Relevant articles and documents

Agonists for the adenosine A1 receptor with tunable residence time. a case for nonribose 4-amino-6-aryl-5-cyano-2-thiopyrimidines

We report the synthesis and evaluation of previously unreported 4-amino-6-aryl-5-cyano-2-thiopyrimidines as selective human adenosine A 1 receptor (hA1AR) agonists with tunable binding kinetics, this without affecting their nanomolar affinity for the target receptor. They show a very diverse range of kinetic profiles (from 1 min (compound 52) to 1 h (compound 43)), and their structure-affinity relationships (SAR) and structure-kinetics relationships (SKR) were established. When put in perspective with the increasing importance of binding kinetics in drug discovery, these results bring new evidence of the consequences of affinity-only driven selection of drug candidates, that is, the potential elimination of slightly less active compounds that may display preferable binding kinetics.