901735-11-3

Basic information

• Product Name: 3-(5,7-DiMethyl-[1,2,4]triazolo[1,5-a]pyriMidin-2-yl)propanoic acid
• Synonyms: 3-(5,7-DiMethyl-[1,2,4]triazolo[1,5-a]pyriMidin-2-yl)propanoic acid
• CAS NO: 901735-11-3
• Molecular Formula: C₁₀H₁₂N₄O₂
• Molecular Weight: 220.22788
• Mol File: 901735-11-3.mol
• Article Data: 2

Chemical Properties

• Appearance: /
• CAS DataBase Reference: 3-(5,7-DiMethyl-[1,2,4]triazolo[1,5-a]pyriMidin-2-yl)propanoic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(5,7-DiMethyl-[1,2,4]triazolo[1,5-a]pyriMidin-2-yl)propanoic acid(901735-11-3)
• EPA Substance Registry System: 3-(5,7-DiMethyl-[1,2,4]triazolo[1,5-a]pyriMidin-2-yl)propanoic acid(901735-11-3)

Safety Data

• Hazardous Substances Data: 901735-11-3(Hazardous Substances Data)

Upstream product

• 108-30-5 succinic acid anhydride 
• 1937-19-5 1-aminoguanidine hydrochloride 
• 123-54-6 acetylacetone 
• 55293-96-4 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbaldehyde 

Relevant articles and documents

Fragment-based discovery of pyrimido[1,2-B]indazole PDE10A inhibitors

In this study, we report the identification of potent pyrimidoindazoles as phosphodiesterase10A (PDE10A) inhibitors by using the method of fragment-based drug discovery (FBDD). The pyrazolopyridine derivative 2 was found to be a fragment hit compound which could occupy a part of the binding site of PDE10A enzyme by using the method of the X-ray co-crystal structure analysis. On the basis of the crystal structure of compound 2 and PDE10A protein, a number of compounds were synthesized and evaluated, by means of structure-activity relationship (SAR) studies, which culminated in the discovery of a novel pyrimidoindazole derivative 13 having good physicochemical properties.