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Fluconazole

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Identification
Molecular formula
C13H12F2N6O
CAS number
86386-73-4
IUPAC name
4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine
State
State

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

Melting point (Celsius)
139.50
Melting point (Kelvin)
412.65
Boiling point (Celsius)
360.30
Boiling point (Kelvin)
633.45
General information
Molecular weight
306.27g/mol
Molar mass
306.2690g/mol
Density
1.4970g/cm3
Appearence

Fluconazole generally appears as a white to off-white crystalline powder. It is odorless and has a bitter taste.

Comment on solubility

Solubility of 4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine (C13H12F2N6O)

The solubility of 4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine can be influenced by various factors, contributing to its overall behavior in different solvents. When analyzing the solubility of this compound, it is essential to consider the following:

  • Polarity: The presence of functional groups like the imidazole ring and pyridine can impart certain polar characteristics, which may increase solubility in polar solvents, such as water or methanol.
  • Hydrophobic interactions: The cyclopropyl and fluorophenyl groups introduce hydrophobic elements that can decrease solubility in aqueous environments while potentially enhancing solubility in organic solvents, such as dichloromethane or ethyl acetate.
  • Interactions with solvents: Complex interactions, including hydrogen bonding and dipole-dipole interactions, will affect how well this compound dissolves in various solvents. For instance, protic solvents may facilitate better solubility due to the ability to form hydrogen bonds.

As a general observation, compounds that possess both polar and non-polar characteristics often demonstrate a unique solubility profile:

  1. They can be soluble in organic solvents due to their hydrophobic nature.
  2. They may exhibit limited solubility in water, especially when hydrophobic groups predominate.
  3. The effective solubility range can depend on temperature and pH, highlighting the importance of environmental conditions.

In summary, the solubility of this compound allows for exploration in various applications, particularly in pharmaceuticals where solubility can greatly impact bioavailability and effectiveness.

Interesting facts

Interesting Facts about 4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine

This compound, known for its complex structure and versatile properties, falls under the category of pharmaceuticals and fine chemicals. Its unique arrangement makes it a significant molecule of interest in medicinal chemistry.

Structural Significance

  • Cyclopropylmethyl Group: The cyclopropyl ring can enhance the compound's binding affinity to specific biological targets, allowing for more efficient interactions in drug design.
  • Imidazole moiety: This five-membered ring can participate in various reactions and interactions due to its nitrogen-rich environment, making it a crucial feature in biological systems.
  • Pyridine Base: The pyridine structure provides basicity and stability, which can influence the compound's solubility and reactivity.

Biological and Chemical Importance

The presence of the fluorine atom in the structure often enhances the compound’s biological activity, as fluorine can significantly affect pharmacokinetics and pharmacodynamics. Compounds like this one are often evaluated for:

  • Antimicrobial activity
  • Fluorescent properties for imaging applications
  • As potential inhibitors in various enzymatic pathways

Quotes in the Field

A famous quote in the realm of drug discovery states: "Design is a constant challenge. The true test of ingenuity is how to configure simplicity into complexity." This resonates with the intricacies involved in creating a compound like 4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine, where multiple components must work harmoniously.

Applications in Research and Industry

Due to its multifaceted structure, this compound can serve as a lead compound for new drugs or therapeutic agents. Researchers continue to investigate its potential applications in:

  • Cancer therapy
  • Neurological disorders
  • Antiviral agents

In conclusion, 4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine is a testament to the precision and creativity required in the field of chemistry. Its unique properties open avenues for scientific exploration, making it an exciting subject of study.

Synonyms
4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-5-(4-PYRIDYL)-IMIDAZOLE
CHEMBL96741
SB-216995
4-[1-(cyclopropylmethyl)-4-(4-fluorophenyl)-1h-imidazol-5-yl]pyridine
PYRIDINYLIMIDAZOLE
sb216995
1bl6
4-[3-(cyclopropylmethyl)-5-(4-fluorophenyl)imidazol-4-yl]pyridine
SB6
SCHEMBL4915662
BDBM15237
DB08522
SB216995; PYRIDINYLIMIDAZOLE
DB-380280
NS00068985
Q27097721
165806-34-8