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Fluorophenyl derivative

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Identification
Molecular formula
C26H28F3N2O4
CAS number
Not Available
IUPAC name
1-[(2S,4S,8R,9R)-3,3-difluoro-19-(4-fluorophenyl)-9,12-dihydroxy-8,10,14-trimethyl-18,19-diazahexacyclo[12.7.0.02,4.05,13.06,10.016,20]henicosa-1(21),16(20),17-trien-9-yl]-2-hydroxy-ethanone
State
State

At room temperature, this compound is a solid. It is likely crystalline due to its molecular structure, which includes several aromatic and alicyclic rings.

Melting point (Celsius)
213.30
Melting point (Kelvin)
486.45
Boiling point (Celsius)
465.50
Boiling point (Kelvin)
738.65
General information
Molecular weight
495.58g/mol
Molar mass
495.5800g/mol
Density
1.2500g/cm3
Appearence

This compound typically appears as a crystalline solid and may exhibit a variety of colors depending on the specific conditions and any impurities that might be present. It may also display a shiny or glossy surface typical of many organic compounds with complex ring structures.

Comment on solubility

Solubility of 1-[(2S,4S,8R,9R)-3,3-difluoro-19-(4-fluorophenyl)-9,12-dihydroxy-8,10,14-trimethyl-18,19-diazahexacyclo[12.7.0.02,4.05,13.06,10.016,20]henicosa-1(21),16(20),17-trien-9-yl]-2-hydroxy-ethanone

The solubility of complex compounds such as 1-[(2S,4S,8R,9R)-3,3-difluoro-19-(4-fluorophenyl)-9,12-dihydroxy-8,10,14-trimethyl-18,19-diazahexacyclo[12.7.0.02,4.05,13.06,10.016,20]henicosa-1(21),16(20),17-trien-9-yl]-2-hydroxy-ethanone can vary significantly depending on several factors:

  • Polarity: The presence of functional groups such as hydroxyl (-OH) and other polar elements may enhance solubility in polar solvents, while the hydrophobic sections may limit it in aqueous environments.
  • Temperature: Generally, increasing temperature can improve solubility for many organic compounds, though exceptions can occur.
  • pH: The solubility of compounds with acidic or basic functional groups can be influenced by the acidity or basicity of the solution.
  • Interactions: Potential interactions with solvents, including hydrogen bonding and Van der Waals forces, can significantly alter solubility.

As noted, “the solubility of a compound is not merely a function of its chemical structure, but a complex interplay of physical and chemical properties.” Therefore, conducting solubility tests in various solvents under controlled conditions is essential to ascertain the solubility behavior of this compound. Its intriguing structural features suggest that it could exhibit unique solubility characteristics, potentially offering insights into its behavior in biological and chemical systems.

Interesting facts

Interesting Facts about 1-[(2S,4S,8R,9R)-3,3-Difluoro-19-(4-fluorophenyl)-9,12-dihydroxy-8,10,14-trimethyl-18,19-diazahexacyclo[12.7.0.02,4.05,13.06,10.016,20]henicosa-1(21),16(20),17-trien-9-yl]-2-hydroxy-ethanone

This compound stands out as a fascinating example of synthetic organic chemistry due to its intricate structure and potential applications. Its complexity is evidenced by the presence of multiple functional groups and stereocenters. Here are some key points to consider:

  • Pharmacological Potential: The compound's unique structure has spurred interest in its potential as a pharmacological agent, particularly in the fields of oncology and infectious diseases.
  • Structural Complexity: With its multi-cyclic framework and numerous stereogenic centers, this molecule poses intriguing challenges for chemists, especially in terms of stereochemistry and chirality.
  • Fluorinated Moieties: The inclusion of difluoro and fluorophenyl groups suggests a significant impact on the compound's reactivity and stability, leading to novel interactions with biological targets.
  • Natural Product Inspiration: The design often borrows principles from natural products, which are maximizing the effectiveness of therapeutic compounds while minimizing side effects.
  • Multi-institutional Collaboration: The synthesis and characterization of such compounds typically require collaboration across various fields of expertise, from synthetic chemistry to computational modeling.

In summary, this compound exemplifies the cutting-edge research occurring at the intersection of synthetic chemistry and drug discovery. As scientists continue to explore its properties, it holds the promise of contributing to advancements in medicinal chemistry. As a student or a researcher venturing into this field, one cannot help but be inspired by the creativity and complexity that such compounds represent.