CAS 160844-75-7

Etil 2-[3-ciano-4-(2-metilpropoxi)fenil]-4-metil-5-tiazolecarboxilato

Descripción:

Etil 2-[3-ciano-4-(2-metilpropoxi)fenil]-4-metil-5-tiazolecarboxilato, con número CAS 160844-75-7, es un compuesto orgánico sintético caracterizado por su estructura compleja, que incluye un anillo de tiazol, un grupo ciano y un grupo funcional de éster etílico. Este compuesto típicamente exhibe propiedades asociadas tanto con derivados de tiazol como con compuestos aromáticos, como una solubilidad moderada en disolventes orgánicos y una reactividad potencial debido a la presencia del grupo ciano. La parte de tiazol puede contribuir a la actividad biológica, lo que lo hace de interés en la investigación farmacéutica. Su estructura molecular sugiere aplicaciones potenciales en química medicinal, particularmente en el desarrollo de nuevos agentes terapéuticos. Además, la presencia del grupo 2-metilpropóxido puede influir en su lipofilia y propiedades farmacocinéticas generales. Al igual que con muchos compuestos orgánicos, se deben considerar los datos de seguridad y las precauciones de manejo, ya que la toxicidad específica y el impacto ambiental de este compuesto tendrían que evaluarse a través de estudios empíricos.

Fórmula: C₁₈H₂₀N₂O₃S

InChI: InChI=1S/C18H20N2O3S/c1-5-22-18(21)16-12(4)20-17(24-16)13-6-7-15(14(8-13)9-19)23-10-11(2)3/h6-8,11H,5,10H2,1-4H3

Clave InChI: InChIKey=OGAZOYHQFBSRMC-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C=1SC(=NC1C)C2=CC(C#N)=C(OCC(C)C)C=C2

Sinónimos:

• 2-(3-Cyano-4-Isobutoxyphenyl)-4-Methylthiazole-5-Carboxylic Acid Ethyl Ester
• 2-[3-Cyano-4-(2-Methylpropoxy)phenyl]-4-Methyl-5-Thiazole Carboxylic Acid Ethyl Ester
• 5-Thiazolecarboxylic acid, 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-, ethyl ester
• Ethyl 2-(3-Cyano-4-IsobutoxyPhenyl)-4-MethylThiazole-5-Carboxylate
• Ethyl 2-[3-Cyano-4-(2-Methylpropoxy)Phenyl]-4-Methyl-1,3-Thiazole-5-Carboxylate
• Ethyl 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-5-Thiazolecarboxylate
• Febuxostat N-5
• Febuxostat intermediates-2
• Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate

5-Thiazolecarboxylic acid, 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-, ethyl ester

CAS: 160844-75-7

Fórmula: C₁₈H₂₀N₂O₃S

Pureza: 97%

Forma y color: Solid

Peso molecular: 344.4280

Ref: IN-DA001VEX

Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate

CAS: 160844-75-7

Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate

Pureza: 98%

Peso molecular: 344.43g/mol

Ref: 54-OR96123

Febuxostat Impurity 3

CAS: 160844-75-7

Fórmula: C₁₈H₂₀N₂O₃S

Forma y color: Off-White Solid

Peso molecular: 344.43

Ref: 4Z-F-3912

Ethyl 2-(3-Cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate

CAS: 160844-75-7

Fórmula: C₁₈H₂₀N₂O₃S

Pureza: >98.0%(HPLC)(N)

Forma y color: White to Almost white powder to crystal

Peso molecular: 344.43

Ref: 3B-E1414

Febuxostat Ethyl Ester (2-[3-Cyano-4-(2-methylpropoxy)phenyl]-4-methyl-5-thiazolecarboxylic Acid Ethyl Ester)

CAS: 160844-75-7

Forma y color: Neat

Ref: 86-MM3552.02

Ethyl 2-(3-Cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate

CAS: 160844-75-7

Applications Ethyl 2-(3-Cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate is an impurity of Febuxostat (F229000), a xanthine oxidase/xanthine dehydrogenase inhibitor. Used for treatment of hyperuricemia and chronic gout. 40-120 mg/day febuxostat was proven effective in lowering serum urate levels when administered to manage hyperuricemia in patients with gout.
References Vallu, V., et. al.: Anal. Chem. Indian J., 14, 339 (2014); Osada, Y., et al.: Eur. J. Pharmacol., 241, 183 (1993); Okamoto, K., et al.: J. Biol. Chem., 278, 1848 (2003); Mayer, M.D., et al.: Am. J. Therap., 12, 22 (2005); Tomlinson, B., et al.: Curr. Opin. Invest. Drugs, 6, 1168 (2005)

Fórmula: C₁₈H₂₀N₂O₃S

Forma y color: Neat

Peso molecular: 344.43

Ref: TR-E907780

Febuxostat Ethyl ester impurity

CAS: 160844-75-7

Fórmula: C₁₈H₂₀N₂O₃S

Peso molecular: 344.43

Ref: ST-EA-CP-F7011

Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate

CAS: 160844-75-7

Fórmula: C₁₈H₂₀N₂O₃S

Pureza: ≥98%

Forma y color: Liquid, No data available.

Peso molecular: 344.43

Ref: 10-F213564

Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate

CAS: 160844-75-7

Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate (ECIT) is a derivative of formyl that has been used as a solvent for industrial and laboratory purposes. ECIT is an amorphous substance with the chemical formula CH3COC6H2CH2COCH=N(C=O)C6H4CN. The compound has been quantified in various solvents, such as n-butyl alcohol and acetonitrile. ECIT is a colorless liquid that boils at 140° C. It has a formyl group and an alkynyl group, which are both reactive groups that can be used to synthesize other compounds. ECIT also contains two stereoisomers: the erythro isomer and the threo isomer. The erythro isomer has the structural formula of CH3COC6H2CH

Pureza: Min. 95%

Ref: 3D-FE45493