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Butyl 4-(3-benzyloxyindazol-1-yl)benzoate

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Identification
Molecular formula
C26H24N2O3
CAS number
263875-53-0
IUPAC name
butyl 4-(3-benzyloxyindazol-1-yl)benzoate
State
State

At room temperature, Butyl 4-(3-benzyloxyindazol-1-yl)benzoate is typically found in a solid state. It is a fine crystalline powder.

Melting point (Celsius)
104.00
Melting point (Kelvin)
377.15
Boiling point (Celsius)
514.70
Boiling point (Kelvin)
787.85
General information
Molecular weight
417.48g/mol
Molar mass
417.4810g/mol
Density
1.2040g/cm3
Appearence

Butyl 4-(3-benzyloxyindazol-1-yl)benzoate typically appears as a white or off-white powder. Its state and color might slightly vary based on the level of purity and specific synthetic conditions.

Comment on solubility

Solubility of Butyl 4-(3-benzyloxyindazol-1-yl)benzoate

The solubility of butyl 4-(3-benzyloxyindazol-1-yl)benzoate can be characterized as a complex interaction influenced by its chemical structure. Here are some key points to consider:

  • Solvent Compatibility: This compound is generally soluble in organic solvents such as ethanol, dimethyl sulfoxide (DMSO), and acetone, while its solubility in water tends to be low.
  • Hydrophobic Interactions: The presence of long hydrocarbon chains in its structure suggests significant hydrophobic characteristics, which often leads to reduced solubility in polar solvents.
  • Structural Factors: The incorporation of the benzyloxy and indazole moieties introduces some degree of polarity due to potential hydrogen bonding, yet the overall hydrophobic nature prevails.
  • Temperature Influence: Like many organic compounds, increasing temperature may enhance the solubility in organic solvents, but the compound's low water solubility remains a consistent characteristic.

In summary, when evaluating butyl 4-(3-benzyloxyindazol-1-yl)benzoate, it is vital to recognize the significance of its structural components, which collectively influence its solubility behavior in various environments. Seeking optimal solvent choices during experiments will facilitate better results when working with this compound.

Interesting facts

Interesting Facts about Butyl 4-(3-benzyloxyindazol-1-yl)benzoate

Butyl 4-(3-benzyloxyindazol-1-yl)benzoate is a fascinating compound that belongs to the class of benzoate esters. This compound has garnered significant interest in the fields of medicinal chemistry and pharmaceuticals due to its unique structure and potential applications. Here are some intriguing aspects:

  • Structural Complexity: One of the standout features of this compound is its intricate architecture, which includes a butyl chain and an indazolyl moiety. Such complex structures often exhibit unique biological activities, making them crucial in drug development.
  • Potential Therapeutic Uses: Research indicates that compounds with indazole derivatives are known for their diverse pharmacological activities, including anticancer, anti-inflammatory, and antimicrobial properties. The presence of the benzyloxy group may enhance these effects, paving the way for novel therapies.
  • Esters in Chemistry: As an ester, butyl 4-(3-benzyloxyindazol-1-yl)benzoate can participate in a variety of chemical reactions, including esterification and hydrolysis. These reactions are central to synthetic organic chemistry and can lead to the development of new compounds.
  • Bioavailability Considerations: The butyl group in this compound may influence its lipophilicity, potentially affecting its absorption and distribution in biological systems. Understanding the pharmacokinetics of such compounds is crucial for evaluating their therapeutic efficacy.
  • Research Opportunities: This compound presents an exciting opportunity for researchers to explore its implications in medicinal chemistry. Studies could focus on synthesizing analogs to enhance its properties or investigating its mechanism of action through biological assays.

In conclusion, butyl 4-(3-benzyloxyindazol-1-yl)benzoate serves as a remarkable example of how structural features in organic compounds can lead to valuable therapeutic potentials. As scientists delve deeper into its properties and applications, it may uncover new avenues in the realm of drug discovery.

Synonyms
ITF 636
28570-58-3
BRN 0857368
BENZOIC ACID, p-(3-(BENZYLOXY)-1H-INDAZOL-1-YL)-, BUTYL ESTER
p-(3-(Benzoyloxy)-1H-indazol-1-yl)benzoic acid butyl ester
DTXSID00182779
5-23-11-00252 (Beilstein Handbook Reference)
RefChem:327829
DTXCID90105270
BUTYL 4-[3-(PHENYLMETHOXY)INDAZOL-1-YL]BENZOATE