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JPC 32159

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Identification
Molecular formula
C28H35FN4O5
CAS number
213785-38-1
IUPAC name
9-(7-fluoro-6-oxo-octyl)-6-(1-methoxyindol-3-yl)-3-sec-butyl-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone
State
State

At room temperature, JPC 32159 is typically in a solid state. It is important to store it in a cool, dry place to prevent degradation or reactions with moisture in the air.

Melting point (Celsius)
125.00
Melting point (Kelvin)
398.15
Boiling point (Celsius)
250.00
Boiling point (Kelvin)
523.15
General information
Molecular weight
513.57g/mol
Molar mass
513.5730g/mol
Density
1.4000g/cm3
Appearence

The compound typically presents as a crystalline solid. Its color can range from white to off-white. The texture tends to be fine and powdery, which is characteristic of many complex organic compounds.

Comment on solubility

Solubility of 9-(7-fluoro-6-oxo-octyl)-6-(1-methoxyindol-3-yl)-3-sec-butyl-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

The compound with the molecular formula C28H35FN4O5 exhibits intriguing solubility characteristics that are influenced by its complex structure. The solubility of chemical compounds is a crucial aspect that determines their applicability in various fields, and this compound is no exception.

Key Factors Influencing Solubility:

  • Polarity: The presence of polar functional groups, such as the methoxy and carbonyl groups, can enhance solubility in polar solvents.
  • Size: The large molecular size may lead to lower solubility due to steric hindrance.
  • Hydrogen Bonding: Functional groups capable of hydrogen bonding can improve solubility in water and other hydrogen bond donors.
  • Fluorination: The fluorine atom can alter the hydrophobicity of the compound, potentially affecting its interaction with solvents.

Considering these factors, it is likely that this compound has limited solubility in water, potentially being more soluble in organic solvents such as ethanol or DMSO. The interactions between the various functional groups create a unique balance, leading to a solubility profile that could be explored further. Understanding the solubility behavior can be valuable for applications in drug design and formulation, where the ability of a compound to dissolve in different solvents plays a vital role in its biological activity and efficacy.

Interesting facts

Interesting Facts about 9-(7-fluoro-6-oxo-octyl)-6-(1-methoxyindol-3-yl)-3-sec-butyl-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

This fascinating compound, known for its complexity and unique structure, showcases the intricate world of organic and medicinal chemistry. Here are some captivating insights:

  • Structural Marvel: The presence of the tetrazabicyclo system in its molecular architecture is particularly intriguing. Bicyclic compounds often exhibit enhanced stability and unique reactivity, which can be harnessed in various applications.
  • Fluorinated Group: The inclusion of the 7-fluoro group is noteworthy as fluorine atoms can greatly influence the compound's reactivity and biological properties, often enhancing lipophilicity and metabolic stability.
  • Biological Significance: Compounds featuring indole derivatives have been extensively studied for their pharmacological potential, as indole moieties can play key roles in drug development, especially for neurological and anti-cancer applications.
  • Potential Applications: Due to its multifaceted structure, this compound could serve various purposes in drug design, particularly in neuropharmacology and cancer treatment, paving the way for innovative therapeutic agents.
  • Synthesis Complexity: The synthetic pathways leading to this compound are elaborate, often involving multiple steps and the use of sophisticated techniques such as coupling reactions and functional group transformations.

As a chemist or a student delving into the world of organic synthesis, exploring compounds like this one illuminates the beauty of molecular diversity and highlights the potential for discovery in medicinal chemistry. Each synthetic route offers not only challenges but also opportunities to innovate and contribute to scientific knowledge. The ongoing research surrounding such compounds may one day lead to groundbreaking medical advancements.