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Talviraline

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Identification
Molecular formula
C24H31N5O3
CAS number
168986-87-0
IUPAC name
2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-N-[1-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)-hydroxy-methyl]-2-methyl-propyl]acetamide
State
State

At room temperature, Talviraline is in a solid state, generally a stable crystalline powder.

Melting point (Celsius)
180.00
Melting point (Kelvin)
453.20
Boiling point (Celsius)
755.50
Boiling point (Kelvin)
1 028.70
General information
Molecular weight
487.58g/mol
Molar mass
487.5780g/mol
Density
1.3600g/cm3
Appearence

Talviraline is typically a white to off-white crystalline powder.

Comment on solubility

Solubility of 2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-N-[1-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)-hydroxy-methyl]-2-methyl-propyl]acetamide

The solubility of the compound C24H31N5O3 can be influenced by several key factors:

  • Polarity: The presence of functional groups like amides and hydroxyls suggests that the compound may exhibit significant polarity, impacting its dissolution in polar solvents such as water.
  • Hydrophobic Regions: The tert-butyl group adds a hydrophobic character, which could lead to decreased solubility in polar solvents but possible solubility in organic solvents.
  • Interactions: Hydrogen bonding capabilities due to amine and hydroxyl groups can enhance solubility in specific polar solvents.
  • Temperature: Similar to many organic compounds, solubility can vary with temperature—higher temperatures often increase solubility.

In summary, while the exact solubility of this particular compound is not readily available, it is plausible to expect it to have moderate solubility in polar solvents and potential higher solubility in non-polar organic solvents due to the diversified structure. As with many complex organic compounds, empirical testing remains the best method for determining precise solubility characteristics.

Interesting facts

Interesting Facts about 2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-N-[1-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)-hydroxy-methyl]-2-methyl-propyl]acetamide

This compound is a fascinating example of medicinal chemistry, demonstrating the intersection of organic synthesis and pharmacological activity. Here are some key points of interest:

  • Dual Functionality: The compound contains structural motifs from both pyrimidine and oxadiazole, which can contribute to its biological properties. The pyrimidine ring is known for its role in nucleic acids, while oxadiazoles often exhibit antimicrobial and anti-inflammatory effects.
  • Enzyme Inhibition: Compounds like this one may act as inhibitors for specific enzymes, providing therapeutic benefits in conditions like cancer or autoimmune diseases. This diversity of action reflects the complex relationships between molecular structure and biological function.
  • Targeted Design: With its carefully crafted structure, this compound is an example of how medicinal chemists design molecules with specific biological targets in mind. The incorporation of various functional groups allows for optimizations in drug selectivity and efficacy.
  • Potential Research Applications: As a subject of ongoing research, this compound may lead to the development of new treatments. Its unique combination of properties makes it a promising candidate for further study in pharmacology and drug design.

In the words of renowned chemist Linus Pauling, "The best way to have a good idea is to have lots of ideas." This compound exemplifies the spirit of innovation in the field of drug discovery.

In conclusion, the complex structure and potential applications make 2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-N-[1-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)-hydroxy-methyl]-2-methyl-propyl]acetamide an intriguing subject for researchers aiming to develop novel therapeutic agents.