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Abacavir

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Identification
Molecular formula
C14H18N6O
CAS number
136470-78-5
IUPAC name
N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine
State
State

At room temperature, Abacavir is typically in a solid state as a crystalline powder.

Melting point (Celsius)
165.00
Melting point (Kelvin)
438.00
Boiling point (Celsius)
600.00
Boiling point (Kelvin)
873.00
General information
Molecular weight
286.33g/mol
Molar mass
286.3310g/mol
Density
1.4375g/cm3
Appearence

The compound appears as a white to off-white powder.

Comment on solubility

Solubility of N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine

N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine, a complex organic compound, exhibits varying solubility characteristics based on its chemical structure. Understanding its solubility is crucial for applications in pharmaceutical formulations and chemical synthesis. Here are some key aspects regarding its solubility:

  • Polar vs. Nonpolar Solvents: The solubility of this compound can differ significantly between polar and nonpolar solvents. Generally, as a purine derivative, it may show increased solubility in polar solvents such as water and methanol.
  • Hydrogen Bonding: The presence of functional groups capable of hydrogen bonding may facilitate solubility in aqueous environments, enabling improved interaction with solvent molecules.
  • pH Dependency: The solubility of N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine can also be pH-dependent, where changes in hydrogen ion concentration could alter its ionization state and, consequently, its solubility.
  • Temperature Influence: In many cases, increasing temperature can enhance solubility, making the compound more soluble in higher temperature environments.

In summary, the solubility profile of N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine is influenced by its structural features, the solvent characteristics, and external conditions such as pH and temperature. This makes a thorough understanding of its solubility crucial for optimizing its use in various scientific and industrial applications.

Interesting facts

Interesting Facts about N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine

N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine is a fascinating compound with numerous implications in the field of medicinal chemistry and molecular biology. Its unique structure features both purine and tetrahydropyran moieties, which contribute to its diverse biological activity. Here are some key points to consider:

  • Structural Diversity: The presence of the benzyl group adds lipophilicity, potentially enhancing cell membrane permeation. The tetrahydropyran ring introduces cyclic constraints that can influence the compound's conformation.
  • Biological Significance: Compounds related to purines are frequently found in biological systems, serving as essential components of nucleotides and nucleic acids. Studies have indicated that purine derivatives can exhibit various pharmacological effects, including anti-inflammatory and anti-cancer properties.
  • Medicinal Chemistry: Research into N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine is ongoing, with particular emphasis on its potential as a therapeutic agent. It is crucial for scientists to explore and synthesize variations of this compound to uncover its full pharmacological potential.
  • Research Applications: This compound may serve as a useful scaffold in drug design and development, particularly in creating novel inhibitors for specific biological targets, thereby contributing to advancements in treatments for various diseases.
  • Importance of Analytical Techniques: Characterizing compounds like N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine requires sophisticated analytical methodologies such as NMR spectroscopy, mass spectrometry, and X-ray crystallography to elucidate its exact structure and ensure the accuracy of synthesized material.

In summary, N-benzyl-9-tetrahydropyran-2-yl-purin-6-amine exemplifies a rich area of study within organic and medicinal chemistry. Its intricate structure combined with the potential for biological activity makes it a compelling subject for researchers striving to unlock new avenues for therapeutic interventions. As the investigation of such compounds progresses, scientists remain hopeful about their ability to contribute significantly to healthcare advancements.

Synonyms
2312-73-4
N-BENZYL-9-(TETRAHYDRO-2H-PYRAN-2-YL)ADENINE
Acell
Caswell No. 083F
PBA (growth stimulant)
9H-Purin-6-amine, N-(phenylmethyl)-9-(tetrahydro-2H-pyran-2-yl)-
SD 8339
N6-Benzyl-9-(2-tetrahydropyranyl)adenine
N-(Phenylmethyl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-amine
EPA Pesticide Chemical Code 110001
N-Benzyl-9-(2-tetrahydropyranyl)adenine
DTXSID8038801
23NQ6S177V
ABG 3039
6-Benzylamino-9-tetrahydropyran-2-yl-9H-purine
Adenine, N-benzyl-9-(tetrahydro-2H-pyran-2-yl)-
DTXCID6018801
ABG-3039
9H-Purine, 6-benzylamino-9-tetrahydropyran-2-yl-
SD-8339
ADENINE, N-BENZYL-9-(TETRAHYDROPYRAN-2-YL)-
6-(BENZYLAMINE)-9-(2-TETRAHYDROPYRANYL)-9H-PURINE
Adenine, N-benzyl-9-(tetrahydro-2H-pyran-2-yl)-(8CI)
621-751-6
Pyranyl benzyladenine
N-Benzyl-9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-amine
BAP9THP
N-benzyl-9-(oxan-2-yl)purin-6-amine
SMR000065644
UNII-23NQ6S177V
BAP9THP?
ChemDiv1_000097
Oprea1_353490
61764-68-9
MLS000098007
MLS002637047
SCHEMBL218275
CHEMBL476190
HMS587E09
POFWRMVFWIJXHP-UHFFFAOYSA-N
HMS2489P08
Tox21_301613
STL510929
AKOS001030389
AKOS016843735
CCG-121004
FB30215
NCGC00255573-01
AC-19706
DA-50939
CAS-2312-73-4
HY-119698
CS-0077827
N-benzyl-9-(oxan-2-yl)-9H-purin-6-amine
NS00124433
SR-01000027858
6-(benzylamino)-9-(2-tetrahydropyranyl)-9h-purine
SR-01000027858-1
Q27253765
Z56780075
Adenine,N-benzyl-9-(tetrahydro-2H-pyran-2-yl)-(8ci)
N-Phenylmethyl)-9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-amine