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Firocoxib

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Identification
Molecular formula
C17H15NO4S
CAS number
189954-96-9
IUPAC name
3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic acid
State
State

At room temperature, Firocoxib exists as a solid. It is typically handled in its amorphous powder form for pharmaceutical formulations, given its stability and ease of processing.

Melting point (Celsius)
170.00
Melting point (Kelvin)
443.15
Boiling point (Celsius)
340.00
Boiling point (Kelvin)
613.15
General information
Molecular weight
336.39g/mol
Molar mass
336.3860g/mol
Density
1.3500g/cm3
Appearence

Firocoxib typically appears as an off-white to tan solid powder. It is a non-crystallizing amorphous compound, which makes it slightly hygroscopic. This compound is known for its use as a veterinary medication, specifically as a nonsteroidal anti-inflammatory drug (NSAID) for dogs and horses.

Comment on solubility

Solubility of 3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic acid

The solubility of 3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic acid (C17H15NO4S) can be quite intriguing due to its complex structure. Understanding its solubility characteristics involves considering various factors:

  • Polar vs Nonpolar: The molecule contains both polar and nonpolar components due to the presence of a sulfonamide group and aromatic rings. This can often lead to limited solubility in purely polar solvents.
  • Solvent Interaction: It is crucial to test solubility in various solvents such as water, ethanol, or DMSO. Polar solvents may engage with the sulfonyl and amine groups, enhancing solubility somewhat, while nonpolar solvents may dissolve the aromatic portions.
  • pH Sensitivity: As an acid, changes in pH can significantly influence solubility. At a lower pH, the acid may remain protonated and more soluble, while at higher pH levels, it may lose the proton and become less soluble.

In general, compounds with sulfonamide groups tend to show moderate solubility in aqueous environments, but their precise behavior can be highly dependent on the molecular context. Thus, the solubility of 3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic acid may be described succinctly as:

“Complex solubility dynamics that warrant experimental exploration.”

For practical applications, it is recommended to assess solubility through laboratory experiments to determine the most effective solvent for this intriguing compound.

Interesting facts

Interesting Facts about 3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic acid

This compound, often abbreviated as 3-phenyl sulfonamide, is a fascinating example of organic chemistry's ability to create versatile drugs. Here are some captivating aspects:

  • Pharmacological Potential: Compounds like 3-phenyl sulfonamide have shown promise in medicinal chemistry, particularly in the development of anti-inflammatory and analgesic medications. This highlights the importance of sulfonamide structures in pharmacology.
  • Synthetic Route: The synthesis of this compound often involves key reactions such as nucleophilic substitution and acylation. Understanding these reactions gives students a profound insight into synthetic organic chemistry techniques.
  • Diverse Applications: Beyond medicinal uses, compounds containing sulfonamide groups are known to exhibit properties in various fields, including agriculture and materials science, showcasing the multifaceted nature of this chemical class.
  • Structure-Activity Relationship: The presence of both phenyl and sulfonyl groups in this compound allows scientists to explore the interplay between structure and activity, enhancing the understanding of how molecular design influences biological behavior.
  • Historical Significance: Sulfonamides, as a class, were among the first antimicrobial agents discovered, leading the way to antibiotics and significantly shaping modern medicine.

In summary, 3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic acid is not just a compound of interest due to its structure, but also plays a crucial role in advancing our understanding of drug development and therapeutic applications. As one researcher aptly stated, "The beauty of organic compounds lies in their ability to adapt and serve myriad functions in both nature and industry."

Synonyms
MMP-2/MMP-9InhibitorI
gelatinase A
193807-58-8
3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic Acid
CLG4A
CHL7O0O94A
TBE-1
72 kDa type IV collagenase
CHEMBL88896
SCHEMBL6545297
DTXSID701054879
HMS3754I03
AKOS040744866
DA-63729
N-([1,1'-biphenyl]-4-ylsulfonyl)-D-phenylalanine
146480-35-5