45741-61-5

Basic information

• Product Name: 4(1H)-PYRIMIDINONE, 5,6-DIAMINO-2-METHYL-
• Synonyms: 4(1H)-PYRIMIDINONE, 5,6-DIAMINO-2-METHYL-;4(1H)-Pyrimidinone, 5,6-diamino-2-methyl- (9CI);5,6-Diamino-2-Methyl-4(1H)-Pyrimidinone;5,6-diaMino-2-Methyl-3H-pyriMidin-4-one;5,6-diaMino-2-MethylpyriMidin-4-ol
• CAS NO: 45741-61-5
• Molecular Formula: C5H8N4O
• Molecular Weight: 140.14
• Product Categories: PYRIMIDINE
• Mol File: 45741-61-5.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 225.5 °C at 760 mmHg
• Flash Point: 90.2 °C
• Appearance: /
• Density: 1.67 g/cm³
• Vapor Pressure: 0.0862mmHg at 25°C
• Refractive Index: 1.736
• CAS DataBase Reference: 4(1H)-PYRIMIDINONE, 5,6-DIAMINO-2-METHYL-(CAS DataBase Reference)
• NIST Chemistry Reference: 4(1H)-PYRIMIDINONE, 5,6-DIAMINO-2-METHYL-(45741-61-5)
• EPA Substance Registry System: 4(1H)-PYRIMIDINONE, 5,6-DIAMINO-2-METHYL-(45741-61-5)

Safety Data

• Hazardous Substances Data: 45741-61-5(Hazardous Substances Data)

Usage

General Description

4(1H)-PYRIMIDINONE, 5,6-DIAMINO-2-METHYL- is a chemical compound with the molecular formula C6H9N5O. It is a derivative of pyrimidine and consists of a pyrimidine ring with two amino groups and a methyl group attached to it. 4(1H)-PYRIMIDINONE, 5,6-DIAMINO-2-METHYL- has potential applications in the pharmaceutical and agricultural industries, as it is used as a building block for the synthesis of various medicinal and agrochemical compounds. Its molecular structure and properties make it suitable for interaction with biological systems and may have potential therapeutic and pesticide applications. Further research and development of this compound may lead to the discovery of new drugs and agrochemicals with improved efficacy and lower environmental impact.

InChI:InChI=1/C5H8N4O/c1-2-8-4(7)3(6)5(10)9-2/h6H2,1H3,(H3,7,8,9,10)

Upstream product

• 1593077-55-4 sodium 5-acetamido-6-amino-2-methylpyrimidin-4-olate 
• 124-42-5 acetamidine hydrochloride 
• 3849-21-6 ethyl cyanoglyoxylate-2-oxime 
• 767-16-8 6-amino-2-methylpyrimidin-4(3H)-one 

Downstream Products

• 98550-74-4 6-chloro-2,8-dimethyl-7⁽⁹⁾H-purine 
• 830330-38-6 2,8-dimethyl-7(9)H-purine 
• 857399-59-8 6,7-bis-(4-methoxy-phenyl)-2-methyl-7,8-dihydro-3H-pteridin-4-one 
• 857399-55-4 2-methyl-6,7-diphenyl-7,8-dihydro-3H-pteridin-4-one 
• 10535-00-9 2-methyl-8-methylsulfanyl-1,7-dihydro-purin-6-one 
• 6267-91-0 2-methyl-8-thioxo-1,7,8,9-tetrahydro-purin-6-one 
• 5167-18-0 2-methyl-1,7-dihydro-purin-6-one 
• 34244-81-0 2,6,7-trimethylpteridin-4(3H)-one 
• 857399-61-2 6,7-bis-(4-methoxy-phenyl)-2-methyl-5,6-dihydro-3H-pteridin-4-one 
• 28176-21-8 N-(4-amino-2-methyl-6-oxo-1,6-dihydro-pyrimidin-5-yl)-N'-phenyl-urea 
• 857399-57-6 2-methyl-6,7-diphenyl-5,6-dihydro-3H-pteridin-4-one 

Relevant articles and documents

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Discovery of 6-phenylpyrimido[4,5- B ][1,4]oxazines as potent and selective Acyl CoA: Diacylglycerol acyltransferase 1 (DGAT1) inhibitors with in vivo efficacy in rodents

The discovery and optimization of a series of acyl CoA:diacylglycerol acyltransferase 1 (DGAT1) inhibitors based on a pyrimido[4,5-b][1,4]oxazine scaffold is described. The SAR of a moderately potent HTS hit was investigated resulting in the discovery of phenylcyclohexylacetic acid 1, which displayed good DGAT1 inhibitory activity, selectivity, and PK properties. During preclinical toxicity studies a metabolite of 1 was observed that was responsible for elevating the levels of liver enzymes ALT and AST. Subsequently, analogues were synthesized to preclude the formation of the toxic metabolite. This effort resulted in the discovery of spiroindane 42, which displayed significantly improved DGAT1 inhibition compared to 1. Spiroindane 42 was well tolerated in rodents in vivo, demonstrated efficacy in an oral triglyceride uptake study in mice, and had an acceptable safety profile in preclinical toxicity studies.