CAS 97614-45-4

1-(3,5-Di-O-benzoyl-2-deoxy-2-fluoro-β-D-arabinofuranosyl)-5-iodo-2,4(1H,3H)-pyrimidinedione

Description:

1-(3,5-Di-O-benzoyl-2-deoxy-2-fluoro-β-D-arabinofuranosyl)-5-iodo-2,4(1H,3H)-pyrimidinedione is a complex organic compound characterized by its unique structural features, which include a pyrimidinedione core and a modified sugar moiety. The presence of the 2-deoxy-2-fluoro-β-D-arabinofuranosyl group suggests that it may exhibit biological activity, potentially as an antiviral or anticancer agent, due to the fluorine substitution which can enhance metabolic stability. The di-O-benzoyl groups indicate that the compound is likely to be lipophilic, which may influence its solubility and permeability in biological systems. The iodine atom in the pyrimidinedione structure can also impart unique reactivity and may be involved in various chemical transformations. Overall, this compound's intricate structure and functional groups suggest potential applications in medicinal chemistry, particularly in the development of nucleoside analogs. However, detailed studies would be necessary to fully elucidate its properties and biological effects.

Formula: C₂₃H₁₈FIN₂O₇

InChI: InChI=1S/C23H18FIN2O7/c24-17-18(34-22(30)14-9-5-2-6-10-14)16(12-32-21(29)13-7-3-1-4-8-13)33-20(17)27-11-15(25)19(28)26-23(27)31/h1-11,16-18,20H,12H2,(H,26,28,31)/t16-,17+,18-,20-/m1/s1

InChI key: InChIKey=FBENGCVQLDKVAT-AJYBTWMASA-N

SMILES: F[C@@H]1[C@@H](O[C@H](COC(=O)C2=CC=CC=C2)[C@H]1OC(=O)C3=CC=CC=C3)N4C(=O)NC(=O)C(I)=C4

Synonyms:

• 1-(3,5-Di-O-benzoyl-2-deoxy-2-fluoro-β-D-arabinofuranosyl)-5-iodo-2,4(1H,3H)-pyrimidinedione
• 2,4(1H,3H)-Pyrimidinedione, 1-(3,5-di-O-benzoyl-2-deoxy-2-fluoro-β-D-arabinofuranosyl)-5-iodo-

3',5'-Di-O-benzoyl fialuridine

CAS: 97614-45-4

Nucleoside, fluoro-modified nucleoside, halo-nucleoside; Arabino-nucleoside

Formula: C₂₃H₁₈FIN₂O₇

Color and Shape: Solid

Molecular weight: 580.3

Ref: TM-TNU0637