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Notably known as a synthetic analogue within research contexts

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Identification
Molecular formula
C23H33NO5S
CAS number
122833-85-4
IUPAC name
2-(butylsulfonylamino)-3-[4-[4-(4-piperidyl)butoxy]phenyl]propanoic acid
State
State
At room temperature, this compound exists as a solid. It is stable under normal conditions and should be stored in a cool, dry place away from direct sunlight.
Melting point (Celsius)
185.00
Melting point (Kelvin)
458.15
Boiling point (Celsius)
320.00
Boiling point (Kelvin)
593.15
General information
Molecular weight
510.68g/mol
Molar mass
510.6780g/mol
Density
1.2500g/cm3
Appearence

The compound appears as an off-white to white powder. The texture could range from crystalline to amorphous, depending on synthesis and purification processes. It is typically not hygroscopic and has a neutral odor.

Comment on solubility

Solubility of 2-(butylsulfonylamino)-3-[4-[4-(4-piperidyl)butoxy]phenyl]propanoic acid

The solubility of the compound C23H33NO5S exhibits interesting characteristics, largely influenced by its chemical structure. This compound contains several functional groups that impact its interaction with solvents:

  • Amine Group: The presence of the piperidine ring contributes to potential hydrogen bonding, which can enhance solubility in polar solvents.
  • Sulfonyl Group: The butylsulfonyl moiety can further increase hydrophilicity, providing a means for solvation in aqueous environments.
  • Hydrophobic Butoxy Chain: Conversely, the butoxy substituent may introduce hydrophobic interactions, complicating solubility in water but possibly favoring solubility in organic solvents.

Overall, the solubility of this compound is characterized by a balance between hydrophilic and hydrophobic properties, which can be summarized as:

  1. **Moderate solubility in polar solvents** due to hydrogen bonding.
  2. **Potential for higher solubility in organic solvents** owing to the hydrophobic components.

In practical applications, it is essential to employ appropriate solvent systems to achieve desired concentrations. Researchers have observed that "the solubility behavior often dictates the bioavailability and efficacy of pharmaceutical compounds." Hence, understanding these solubility characteristics is crucial for guiding formulation strategies and therapeutic applications.

Interesting facts

Interesting Facts about 2-(butylsulfonylamino)-3-[4-[4-(4-piperidyl)butoxy]phenyl]propanoic acid

2-(butylsulfonylamino)-3-[4-[4-(4-piperidyl)butoxy]phenyl]propanoic acid is a compound that exhibits unique properties and potential applications in various fields. Here are some intriguing aspects of this compound:

  • Pharmacological Relevance: This compound is noted for its interesting pharmacological profile, which may include functions related to CNS activity and modulation of neurotransmitter systems.
  • Structural Complexity: The structure of this compound showcases a multifaceted design, integrating:
    • A sulfonamide group, which is known for enhancing solubility and biological activity.
    • A piperidine moiety that is often associated with psychotropic effects.
    • A long alkyl chain that aids in increasing membrane penetration.
  • Synthetic Challenges: The synthesis of compounds with such intricate structures poses significant challenges, often requiring multiple steps and careful control of reaction conditions.
  • Potential for Research: Compounds like this are often the subject of research in medicinal chemistry, with ongoing studies looking at their efficacy in treating various conditions, including mental health disorders.

As a scientist or a student of chemistry, exploring compounds like 2-(butylsulfonylamino)-3-[4-[4-(4-piperidyl)butoxy]phenyl]propanoic acid opens a window into the fascinating world of drug design and development. The interplay between structure and function in such compounds is critical for advancing our understanding of pharmaceutical science.

Synonyms
(R)-Tirofiban
158808-86-7
2-(butylsulfonylamino)-3-[4-(4-piperidin-4-ylbutoxy)phenyl]propanoic acid
R-Tirofiban
SCHEMBL618214
DTXSID70861403
HMS3741G17
AKOS040758972
NCGC00389295-01
LS-14970
DB-063541
N-(Butane-1-sulfonyl)-O-[4-(piperidin-4-yl)butyl]tyrosine