CAS 1383816-29-2: 2-[(3-endo)-3-[[5-Cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-4-isoxazolyl]methoxy]-8-azabicyclo[3.2.1]oct-8-yl]-4-fluoro-6-benzothiazolecarboxylic acid

Description: The chemical substance with the name "2-[(3-endo)-3-[[5-Cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-4-isoxazolyl]methoxy]-8-azabicyclo[3.2.1]oct-8-yl]-4-fluoro-6-benzothiazolecarboxylic acid" and CAS number 1383816-29-2 is characterized by its complex molecular structure, which includes multiple functional groups and bicyclic systems. This compound features a bicyclic azabicyclo structure, indicating the presence of nitrogen in a cyclic arrangement, which may contribute to its biological activity. The presence of a benzothiazole moiety suggests potential interactions with biological targets, as benzothiazoles are known for their pharmacological properties. Additionally, the trifluoromethoxy group enhances lipophilicity and may influence the compound's solubility and permeability. The cyclopropyl group can also affect the compound's conformational flexibility and reactivity. Overall, this substance is likely to exhibit specific pharmacokinetic and pharmacodynamic properties, making it of interest in medicinal chemistry, particularly in the development of therapeutic agents. Further studies would be necessary to elucidate its biological activity and potential applications.

Formula: C₂₉H₂₅F₄N₃O₅S

InChI: InChI=1/C29H25F4N3O5S/c30-21-9-15(27(37)38)10-23-25(21)34-28(42-23)36-16-7-8-17(36)12-18(11-16)39-13-20-24(35-41-26(20)14-5-6-14)19-3-1-2-4-22(19)40-29(31,32)33/h1-4,9-10,14,16-18H,5-8,11-13H2,(H,37,38)/t16-,17+,18+

InChI key: InChIKey=VYLOOGHLKSNNEK-PIIMJCKONA-N

SMILES: O=C(O)C=1C=C(F)C=2N=C(SC2C1)N3C4CCC3CC(OCC=5C(=NOC5C6CC6)C=7C=CC=CC7OC(F)(F)F)C4

Synonyms:

• LJN452
• Tropifexor
• LJN 452
• 6-Benzothiazolecarboxylic acid, 2-[(3-endo)-3-[[5-cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-4-isoxazolyl]methoxy]-8-azabicyclo[3.2.1]oct-8-yl]-4-fluoro-
• 2-[(3-endo)-3-[[5-Cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-4-isoxazolyl]methoxy]-8-azabicyclo[3.2.1]oct-8-yl]-4-fluoro-6-benzothiazolecarboxylic acid
• 2-[(1R,3r,5S)-3-({5-cyclopropyl-3-[2-(trifluoromethoxy)phenyl]-1,2-oxazol-4-yl}methoxy)-8-azabicyclo[3.2.1]octan-8-yl]-4-fluoro-1,3-benzothiazole-6-carboxylic acid
• LJN-452

Tropifexor

CAS: 1383816-29-2

• Formula: C₂₉H₂₅F₄N₃O₅S
• Purity: 98%
• Color and Shape: Solid
• Molecular weight: 603.5845

Tropifexor

CAS: 1383816-29-2

• Purity: 99.29%
• Molecular weight: 603.58g/mol

Rel-2-((1R,3R,5S)-3-((5-Cyclopropyl-3-(2-(Trifluoromethoxy)Phenyl)Isoxazol-4-Yl)Methoxy)-8-Azabicyclo[3.2.1]Octan-8-Yl)-4-Fluorobenzo[D]Thiazole-6-Carboxylic Acid

CAS: 1383816-29-2

• Purity: 98%
• Molecular weight: 603.58g/mol

Tropifexor

CAS: 1383816-29-2

Tropifexor (LJN452) is a novel and highly potent agonist of FXR with an EC50 of …

• Formula: C₂₉H₂₅F₄N₃O₅S
• Purity: 99.1% - 99.85%
• Color and Shape: Solid
• Molecular weight: 603.58

Tropifexor

CAS: 1383816-29-2

Please enquire for more information about Tropifexor including the price, delivery time and more detailed …

• Formula: C₂₉H₂₅F₄N₃O₅S
• Purity: Min. 95%
• Molecular weight: 603.59 g/mol