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CAS 96865-83-7

:

[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetic acid

Description:
The chemical substance known as [4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetic acid, with the CAS number 96865-83-7, is a synthetic compound that features a complex structure incorporating both purine and phenoxy functionalities. This compound is characterized by its dual functional groups: the phenoxy group, which is known for its role in various biological activities, and the acetic acid moiety, which can influence solubility and reactivity. The presence of the dioxo and dipropyl substituents on the purine ring suggests potential interactions with biological targets, possibly indicating pharmacological relevance. The compound may exhibit properties such as moderate to high solubility in organic solvents, depending on the specific conditions, and could participate in hydrogen bonding due to the presence of acidic protons. Its structural complexity may also suggest potential for diverse biological activities, making it of interest in medicinal chemistry and drug development. However, specific biological effects and applications would require further investigation through empirical studies.
Formula:C19H22N4O5
InChI:InChI=1/C19H22N4O5/c1-3-9-22-17-15(18(26)23(10-4-2)19(22)27)20-16(21-17)12-5-7-13(8-6-12)28-11-14(24)25/h5-8H,3-4,9-11H2,1-2H3,(H,20,21)(H,24,25)
SMILES:CCCn1c2c(c(=O)n(CCC)c1=O)[nH]c(c1ccc(cc1)OCC(=O)O)n2
Synonyms:
  • [4-(2,6-dioxo-1,3-dipropyl-2,3,6,9-tetrahydro-1H-purin-8-yl)phenoxy]acetic acid
  • acetic acid, 2-[4-(2,3,6,9-tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)phenoxy]-
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