CAS 1350653-29-0

2-[5-Fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(1E)-2-phenyldiazenyl]-4,6-pyrimidinediamine

Description:

The chemical substance known as "2-[5-Fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(1E)-2-phenyldiazenyl]-4,6-pyrimidinediamine" with CAS number 1350653-29-0 is a complex organic compound characterized by multiple functional groups and a diverse molecular structure. It features a pyrazolo-pyridine core, which is fused with a pyrimidine moiety, indicating potential biological activity. The presence of fluorine atoms suggests enhanced lipophilicity and may influence the compound's pharmacokinetic properties. The azobenzene group (2-phenyldiazenyl) introduces potential for photoisomerization, which can be exploited in various applications, including drug delivery systems. The compound's intricate structure may contribute to its specificity and efficacy in biological systems, making it a candidate for further research in medicinal chemistry. Overall, its unique arrangement of heterocycles and substituents positions it as a potentially valuable compound in the development of therapeutic agents.

Formula: C₂₃H₁₇F₂N₉

InChI: InChI=1S/C23H17F2N9/c24-14-10-16-18(33-34(23(16)28-11-14)12-13-6-4-5-9-17(13)25)22-29-20(26)19(21(27)30-22)32-31-15-7-2-1-3-8-15/h1-11H,12H2,(H4,26,27,29,30)/b32-31+

InChI key: InChIKey=FGVPZKOMCCRZTI-QNEJGDQOSA-N

SMILES: C(N1N=C(C=2C1=NC=C(F)C2)C=3N=C(N)C(/N=N/C4=CC=CC=C4)=C(N)N3)C5=C(F)C=CC=C5

Synonyms:

• 4,6-Pyrimidinediamine, 2-[5-fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(1E)-2-phenyldiazenyl]-
• 2-[5-Fluoro-1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(1E)-2-phenyldiazenyl]-4,6-pyrimidinediamine
• (E)-2-(5-Fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-(phenyldiazenyl)pyrimidine-4,6-diamine
• 2-(5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-5-(phenyldiazenyl)pyrimidine-4,6-diamine
• 2-[5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-[(E)-phenyldiazenyl]pyrimidine-4,6-diamine