CAS 333962-91-7

2-Amino-4-(4-hydroxyphenyl)-6-[(1H-imidazol-2-ylmethyl)thio]-3,5-pyridinedicarbonitrile

Description:

2-Amino-4-(4-hydroxyphenyl)-6-[(1H-imidazol-2-ylmethyl)thio]-3,5-pyridinedicarbonitrile, with CAS number 333962-91-7, is a complex organic compound characterized by its multi-functional groups, including amino, hydroxy, and thioether moieties. This compound features a pyridine ring substituted with two cyano groups, which contribute to its potential reactivity and biological activity. The presence of the imidazole ring suggests possible interactions with biological targets, making it of interest in medicinal chemistry. The hydroxyphenyl group may enhance solubility and provide sites for further chemical modifications. Its structural complexity indicates potential applications in pharmaceuticals, particularly in the development of novel therapeutic agents. The compound's properties, such as solubility, stability, and reactivity, would depend on the specific conditions under which it is studied, including pH and solvent environment. Overall, this substance represents a class of compounds that may exhibit significant biological activity, warranting further investigation into its pharmacological potential.

Formula: C₁₇H₁₂N₆OS

InChI: InChI=1S/C17H12N6OS/c18-7-12-15(10-1-3-11(24)4-2-10)13(8-19)17(23-16(12)20)25-9-14-21-5-6-22-14/h1-6,24H,9H2,(H2,20,23)(H,21,22)

InChI key: InChIKey=OFHKDLYFKPBXER-UHFFFAOYSA-N

SMILES: C(#N)C=1C(=C(C#N)C(N)=NC1SCC=2NC=CN2)C3=CC=C(O)C=C3

Synonyms:

• 2-Amino-4-(4-hydroxyphenyl)-6-[(1H-imidazol-2-ylmethyl)thio]-3,5-pyridinedicarbonitrile
• 2-Amino-4-(4-hydroxy-phenyl)-6-(1H-imidazol-2-ylmethylsulfanyl)-pyridine-3,5-dicarbonitrile
• 3,5-Pyridinedicarbonitrile, 2-amino-4-(4-hydroxyphenyl)-6-[(1H-imidazol-2-ylmethyl)thio]-
• 2-(((1H-Imidazol-2-yl)methyl)thio)-6-amino-4-(4-hydroxyphenyl)pyridine-3,5-dicarbonitrile
• LUF 5834

LUF 5834

CAS: 333962-91-7

A2A and A2B adenosine receptor partial agonist

Formula: C₁₇H₁₂N₆OS

Purity: 98%

Color and Shape: Solid

Molecular weight: 348.38

Ref: TM-T22937

LUF 5834

CAS: 333962-91-7

LUF 5834 is a novel adenosine A1 receptor agonist that has been shown to have significant efficacy in vivo against inflammatory diseases. It was found to be a potent and selective agonist of the A1 receptor in vitro. LUF 5834 also had an allosteric modulating effect on the adenosine A3 receptor, which is involved in immune and inflammatory responses. LUF 5834 binds to both the adenosine A1 receptor and the A3 receptor with high affinity and selectivity, but does not bind to any other adenosine receptors at concentrations up to 10 μM. The binding site for LUF 5834 on the A1 receptor was determined by molecular modeling studies as well as binding experiments. These results suggest that LUF 5834 can be used for treating inflammatory diseases or other disorders involving inflammation.

Formula: C₁₇H₁₂N₆OS

Purity: Min. 95%

Molecular weight: 348.38 g/mol

Ref: 3D-INA96291