2057-01-4

Basic information

• Product Name: 1,3-Cyclohexanedione, 2-acetyl-5-phenyl-
• CAS NO: 2057-01-4
• Molecular Formula: C14H14O3
• Molecular Weight: 230.263
• Mol File: 2057-01-4.mol
• Article Data: 5

Chemical Properties

• CAS DataBase Reference: 1,3-Cyclohexanedione, 2-acetyl-5-phenyl-(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3-Cyclohexanedione, 2-acetyl-5-phenyl-(2057-01-4)
• EPA Substance Registry System: 1,3-Cyclohexanedione, 2-acetyl-5-phenyl-(2057-01-4)

Safety Data

• Hazardous Substances Data: 2057-01-4(Hazardous Substances Data)

Usage

Chemical class

Cyclic ketones

Physical state

White to light yellow crystalline solid

Usage

Building block for pharmaceuticals and agrochemicals

Odor

Sweet, floral

Application in food industry

Flavoring agent

Application in fragrance industry

Perfumes and other fragrance products

Potential applications

Medicinal chemistry and drug development

Pharmacological properties

Not specified in the material provided

Upstream product

• 110-86-1 pyridine 
• 92190-35-7 5-oxo-1,2,5,6-tetrahydro-[1,1′-biphenyl]-3-yl acetate 
• 108-24-7 acetic anhydride 
• 102-69-2 tri-n-propylamine 
• 493-72-1 5-phenyl-cyclohexane-1,3-dione 
• 127-09-3 sodium acetate 
• 1896-62-4 (E)-benzalacetone 
• 75-36-5 acetyl chloride 

Downstream Products

• 55634-20-3 2-(1-Allyloxyamino-ethylidene)-5-phenyl-cyclohexane-1,3-dione 
• 55634-12-3 2-(1-Ethoxyamino-ethylidene)-5-phenyl-cyclohexane-1,3-dione 
• 4165-96-2 3-phenylglutaric acid 
• 401838-40-2 C₂₁H₂₁NO₂ 
• 1609374-82-4 2-(1-((2-chlorophenyl)amino)ethylidene)-5-phenylcyclohexane-1,3-dione 
• 1609374-83-5 2-(1-((2-fluorophenyl)amino)ethylidene)-5-phenylcyclohexane-1,3-dione 
• 1609374-84-6 5-phenyl-2-(1-((2-(trifluoromethyl)phenyl)amino)ethylidene)cyclohexane-1,3-dione 
• 1609374-85-7 2-(1-((2,3-difluorophenyl)amino)ethylidene)-5-phenylcyclohexane-1,3-dione 
• 1609374-86-8 2-(1-((2,6-difluorophenyl)amino)ethylidene)-5-phenylcyclohexane-1,3-dione 
• 1609374-88-0 2-(1-((2,6-dimethoxyphenyl)amino)ethylidene)-5-phenylcyclohexane-1,3-dione 
• 395078-88-3 2-(1-((2-methoxyphenyl)amino)ethylidene)-5-phenylcyclohexane-1,3-dione 

Relevant articles and documents

Tetrahydroindazole inhibitors of CDK2/cyclin complexes

Over 50 tetrahydroindazoles were synthesized after 7-bromo-3,6,6-trimethyl-1-(pyridin-2-yl)-5,6,7,7a-tetrahydro-1H-indazol-4(3aH)-one (3) was identified as a hit compound in a high throughput screen for inhibition of CDK2 in complex with cyclin A. The activity of the most promising analogues was evaluated by inhibition of CDK2 enzyme complexes with various cyclins. Analogues 53 and 59 showed 3-fold better binding affinity for CDK2 and 2- to 10-fold improved inhibitory activity against CDK2/cyclin A1, E, and O compared to screening hit 3. The data from the enzyme and binding assays indicate that the binding of the analogues to a CDK2/cyclin complex is favored over binding to free CDK2. Computational analysis was used to predict a potential binding site at the CDK2/cyclin E1 interface.

A CLASS OF ISOINDOLONE-IMIDE RING-1,3-DIONE-2-ENE COMPOUNDS, COMPOSITION AND USE THEREOF

The present invention provides an isoindolone-imide ring-1,3-dione-2-ene compound, and a preparation method, a pharmaceutical composition and use thereof. Specifically, the present invention provides a compound of Formula (I) below or a pharmaceutically a

Antiviral and Antimicrobial Activity of 2,4-Diacylphloroglucinols, 2-Acylcyclohexane-1,3-diones and 2-Carboxamidocyclohexane-1,3-diones

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