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Combretastatin A-4

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Identification
Molecular formula
C18H20NO5
CAS number
117048-59-6
IUPAC name
1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
State
State

At room temperature, this compound is typically found in a solid state. It is commonly handled as a crystalline powder in chemical and pharmaceutical settings.

Melting point (Celsius)
184.00
Melting point (Kelvin)
457.15
Boiling point (Celsius)
368.20
Boiling point (Kelvin)
641.35
General information
Molecular weight
316.35g/mol
Molar mass
316.3530g/mol
Density
1.2000g/cm3
Appearence

This compound typically appears as a pale yellow to off-white solid. The purity and crystallinity can affect the exact shade of yellow or off-white observed.

Comment on solubility

Solubility of 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-(4-methoxyphenyl)prop-2-en-1-one

The solubility characteristics of this complex organic compound can be quite diverse depending on various factors. Here are some key points to consider:

  • Polarity: The presence of multiple functional groups, particularly the dimethylamino and methoxy groups, generally increases the polarity of the molecule, potentially enhancing its solubility in polar solvents like water and alcohols.
  • Solvent Dependence: In organic solvents, this compound may display higher solubility due to hydrophobic interactions between its non-polar aromatic portions and the solvent molecules.
  • Temperature Influence: As with many organic compounds, increasing the temperature can result in improved solubility, allowing for better dissolution in both aqueous and organic systems.
  • pH Effects: Changes in pH can affect the ionization of the dimethylamino group, leading to variations in solubility. In acidic conditions, the compound might become more soluble due to protonation.
  • Concentration: Understanding saturation limits is crucial; at higher concentrations, solubility might be impacted due to precipitation or other physical changes.

In summary, the solubility of 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-(4-methoxyphenyl)prop-2-en-1-one is influenced by its structural features, the choice of solvent, and the environmental conditions. For practical applications, it is advisable to conduct solubility tests in specific solvents to determine the best conditions for use.

Interesting facts

Interesting Facts About 1-[6-[2-(Dimethylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-(4-methoxyphenyl)prop-2-en-1-one

This compound, often referred to in the context of medicinal chemistry, features a fascinating structure that highlights the intersection of organic synthesis and pharmacology. Here are some captivating details about its characteristics and potential uses:

  • Structural Complexity: The elaborate structure contains both benzofuran and dimethoxy groups. This complexity may contribute to its biological activity by influencing how it interacts with various biological targets.
  • Pharmacological Potential: Compounds with benzofuran derivatives are often investigated for their pharmacological properties, including anti-inflammatory, analgesic, and anticancer activities. This compound is a subject of interest in studies aiming to understand its therapeutic profiles.
  • Role of Dimethylamino Group: The presence of the dimethylamino group suggests that this compound may exhibit enhanced lipophilicity, potentially improving its ability to cross cell membranes. This aspect is crucial for drug delivery and efficacy.
  • Research Applications: Due to its unique chemical structure, this compound can be a valuable tool in medicinal chemistry for synthesizing related compounds or exploring structure-activity relationships.
  • In Silico Studies: Researchers often employ computational methods to predict the behavior of such compounds in biological systems, facilitating the optimization of lead compounds in drug discovery.

In summary, 1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-benzofuran-5-yl]-3-(4-methoxyphenyl)prop-2-en-1-one stands as an intriguing molecular candidate for further research. Scientists are continuously exploring its properties to unlock new therapeutic avenues.

Synonyms
DTXSID901043264
1-[6-[2-(Dimethylamino)ethoxy]-4,7-dimethoxy-5-benzofuranyl]-3-(4-methoxyphenyl)-2-propen-1-one
NS00050668
1-[6-[2-(dimethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]-3-(4-methoxyphenyl)prop-2-en-1-one