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CAS 180587-75-1

:

Diethyl P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]phosphonate

Description:
Diethyl P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]phosphonate, commonly referred to by its CAS number 180587-75-1, is a chemical compound characterized by its phosphonate structure, which includes a phosphorus atom bonded to oxygen and carbon groups. This compound features a purine derivative, specifically an amino-substituted purine, which contributes to its biological activity. The presence of the diethyl group indicates that it has two ethyl substituents, enhancing its lipophilicity and potential for membrane permeability. The compound is likely to exhibit properties typical of phosphonates, such as stability under various conditions and potential reactivity with nucleophiles. Its structural complexity suggests potential applications in medicinal chemistry, particularly in the development of antiviral or anticancer agents, given the purine moiety's role in nucleic acid metabolism. Additionally, the stereochemistry indicated by the (1R) configuration may influence its biological interactions and efficacy. Overall, this compound represents a significant interest in pharmaceutical research due to its unique structural features and potential therapeutic applications.
Formula:C13H22N5O4P
InChI:InChI=1S/C13H22N5O4P/c1-4-21-23(19,22-5-2)9-20-10(3)6-18-8-17-11-12(14)15-7-16-13(11)18/h7-8,10H,4-6,9H2,1-3H3,(H2,14,15,16)/t10-/m1/s1
InChI key:InChIKey=GCOFRXOOFANVPB-SNVBAGLBSA-N
SMILES:C([C@H](OCP(OCC)(OCC)=O)C)N1C=2C(N=C1)=C(N)N=CN2
Synonyms:
  • (R)-9-[2-(Diethylphosphonomethoxy)Propyl] Adenine
  • Diethyl P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]phosphonate
  • Diethyl tenofovir
  • Phosphonic acid, P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, diethyl ester
  • Phosphonic acid, [[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, diethyl ester
  • Phosphonic acid, [[2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, diethyl ester, (R)-
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