CAS 725247-18-7

3-[4-[[2,4-Bis(trifluoromethyl)phenyl]methoxy]-3-methoxyphenyl]-2-cyano-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2-propenamide

Description:

The chemical substance known as 3-[4-[[2,4-Bis(trifluoromethyl)phenyl]methoxy]-3-methoxyphenyl]-2-cyano-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2-propenamide, with the CAS number 725247-18-7, is characterized by its complex molecular structure, which includes multiple functional groups such as a cyano group, amide linkage, and trifluoromethyl substituents. This compound is likely to exhibit significant lipophilicity due to the presence of trifluoromethyl groups, which can enhance its biological activity and solubility in organic solvents. The thiadiazole moiety may contribute to its potential pharmacological properties, possibly influencing its interaction with biological targets. Additionally, the methoxy and bis(trifluoromethyl)phenyl groups may enhance its stability and reactivity. Given its intricate structure, this compound may be of interest in medicinal chemistry, particularly in the development of novel therapeutic agents. However, specific properties such as melting point, boiling point, and solubility would require empirical determination or literature reference for precise characterization.

Formula: C₂₃H₁₃F₉N₄O₃S

InChI: InChI=1S/C23H13F9N4O3S/c1-38-17-7-11(6-13(9-33)18(37)34-20-36-35-19(40-20)23(30,31)32)2-5-16(17)39-10-12-3-4-14(21(24,25)26)8-15(12)22(27,28)29/h2-8H,10H2,1H3,(H,34,36,37)

InChI key: InChIKey=HQFNFOOGGLSBBT-UHFFFAOYSA-N

SMILES: C(OC1=C(OC)C=C(C=C(C(NC=2SC(C(F)(F)F)=NN2)=O)C#N)C=C1)C3=C(C(F)(F)F)C=C(C(F)(F)F)C=C3

Synonyms:

• (2E)-3-(4-{[2,4-Bis(trifluoromethyl)benzyl]oxy}-3-methoxyphenyl)-2-cyano-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
• 2-Propenamide, 3-[4-[[2,4-bis(trifluoromethyl)phenyl]methoxy]-3-methoxyphenyl]-2-cyano-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-
• 2-Propenamide, 3-[4-[[2,4-bis(trifluoromethyl)phenyl]methoxy]-3-methoxyphenyl]-2-cyano-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-, (2E)-
• 3-[4-[[2,4-Bis(trifluoromethyl)benzyl]oxy]-3-methoxyphenyl]-2-cyano-N-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)acrylamide
• 3-[4-[[2,4-Bis(trifluoromethyl)phenyl]methoxy]-3-methoxyphenyl]-2-cyano-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2-propenamide
• Xct 790

XCT790

CAS: 725247-18-7

Formula: C₂₃H₁₃F₉N₄O₃S

Molecular weight: 596.42

Ref: 7W-GL0936

XCT790

CAS: 725247-18-7

XCT790

Purity: ≥98%

Molecular weight: 596.42g/mol

Ref: 54-BUP06697

XCT790

CAS: 725247-18-7

XCT790 is a potent, selective and inverse agonist of estrogen-related receptor alpha(ERRα).

Formula: C₂₃H₁₃F₉N₄O₃S

Purity: 99% - 99.61%

Color and Shape: Solid

Molecular weight: 596.42

Ref: TM-T0593

XCT790

Controlled Product

CAS: 725247-18-7

Formula: C₂₃H₁₃F₉N₄O₃S

Color and Shape: Neat

Molecular weight: 596.425

Ref: TR-X750933