WAY-362450

• CAT Number: I004371
• CAS Number: 629664-81-9
• Molecular Formula: C25H24F2N2O3
• Molecular Weight: 438.48
• Purity: ≥95%
• Target: FXR
• Solubility: DMSO: ≤ 15 mg/mL
• Storage: room temp
• IC50: 4 nM (EC50)
• IUPAC Name: propan-2-yl 3-(3,4-difluorobenzoyl)-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylate
• InChI: InChI=1S/C25H24F2N2O3/c1-14(2)32-24(31)17-12-29(23(30)15-9-10-18(26)19(27)11-15)13-25(3,4)21-16-7-5-6-8-20(16)28-22(17)21/h5-12,14,28H,13H2,1-4H3
• InChIKey: INASOKQDNHHMRE-UHFFFAOYSA-N
• SMILES: CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)C4=CC(=C(C=C4)F)F

Turofexorate Isopropyl (Cat No.:I004371) is a potent and selective agonist of the farnesoid X receptor (FXR) with an EC50 of 4 nM. It exhibits high selectivity towards FXR, distinguishing it from other nuclear receptors such as the liver X receptor (LXR), peroxisome proliferator-activated receptor (PPAR), and estrogen receptor (ER). By activating FXR, Turofexorate Isopropyl modulates various biological processes and pathways associated with lipid metabolism, bile acid regulation, and inflammation.

Reference

1:Farnesoid X receptor agonist WAY-362450 attenuates liver inflammation and fibrosis in murine model of non-alcoholic steatohepatitis. Zhang S, Wang J, Liu Q, Harnish DC.J Hepatol. 2009 Aug;51(2):380-8. doi: 10.1016/j.jhep.2009.03.025. Epub 2009 May 18. PMID: 19501927 2:Discovery of XL335 (WAY-362450), a highly potent, selective, and orally active agonist of the farnesoid X receptor (FXR). Flatt B, Martin R, Wang TL, Mahaney P, Murphy B, Gu XH, Foster P, Li J, Pircher P, Petrowski M, Schulman I, Westin S, Wrobel J, Yan G, Bischoff E, Daige C, Mohan R.J Med Chem. 2009 Feb 26;52(4):904-7. doi: 10.1021/jm8014124. PMID: 19159286