XCT790

SIGMA/X4753 - ≥98% (HPLC), solid

Synonym: 3-[4-(2,4-Bis-trifluoromethylbenzyloxy)-3-methoxyphenyl]-2-cyano-N-(5-trifluoromethyl-1,3,4-thiadiazol-2-yl)acrylamide

CAS Number: 725247-18-7
Empirical Formula (Hill Notation): C₂₃H₁₃F₉N₄O₃S
Molecular Weight: 596.42
MDL Number: MFCD08277031
Linear Formula: C₂₃H₁₃F₉N₄O₃S
Product Type: Chemical

Catalog Number	PKG Qty.	Price


45-X4753-5MG	5 mg	$223.00 1/EA	Add To Favorites
45-X4753-25MG	25 mg	$856.00 1/EA	Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	≥98% (HPLC)
color	yellow
form	solid
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)/b13-6+
InChI key	HQFNFOOGGLSBBT-AWNIVKPZSA-N
Quality Level	100
SMILES string	COc1cc(ccc1OCc2ccc(cc2C(F)(F)F)C(F)(F)F)C=C(/C#N)C(=O)Nc3nnc(s3)C(F)(F)F
solubility	DMSO: ≥10 mg/mL
storage temp.	2-8°C

Application:	XCT790 has been used: • as an estrogen-related receptor (ERR)α inverse agonist in C2C12 myotubes • as an estrogen-related receptor (ERR)α inverse agonist to elucidate decidualization functionality of ERRα in endometrial embryonic stem cells • as an autophagy inducer in human neuroblastoma SH-SY5Y and HeLa cell lines.
Biochem/physiol Actions:	XCT 790 is a 5′adenosine monophosphate-activated protein kinase (AMPK) activator. It also acts as a proton ionophore and an uncoupler of oxidative phosphorylation in mitochondria. XCT790 impairs vascular endothelial growth factor (VEGF) and angiopoietin 2 (Ang-2) expression and exhibits suppression of endometrial tumor via estrogen-related receptor (ERRα) inhibition. XCT790 mediates cell cycle arrest and favors apoptosis in triple-negative breast cancer (TNBC).
Biochem/physiol Actions:	XCT790 is a potent and specific inverse agonist of ERRα. XCT790 is selective; showing no significant antagonist activity on related nuclear receptors, such as ERRγ or ERα at concentrations below 10 μM. XCT790 inhibits the constitutive activity of ERRα in both biochemical and cell-based assays. The IC₅₀ value is 300-500 nM in transient transfection assays using GAL4-ERR LBD or full-length ERR with the mSHP promoter.
Packaging:	5, 25 mg in glass bottle

Hazard statements	H413
RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	Not applicable
Flash Point(C)	Not applicable

Purity	≥98% (HPLC)
Storage Temp.	2-8°C
UNSPSC	12352202

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