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Migalastat

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Identification
Molecular formula
C12H23N3O4
CAS number
169590-42-5
IUPAC name
2-[4-amino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-6-(ethylamino)-2-hydroxy-cyclohexoxy]-5-methyl-4-(methylamino)tetrahydropyran-3,5-diol
State
State

Migalastat is a solid at room temperature.

Melting point (Celsius)
226.50
Melting point (Kelvin)
499.70
Boiling point (Celsius)
354.50
Boiling point (Kelvin)
627.70
General information
Molecular weight
329.38g/mol
Molar mass
329.3760g/mol
Density
1.4000g/cm3
Appearence

Migalastat appears as a crystalline white powder.

Comment on solubility

Solubility of 2-[4-amino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-6-(ethylamino)-2-hydroxy-cyclohexoxy]-5-methyl-4-(methylamino)tetrahydropyran-3,5-diol (C12H23N3O4)

The solubility of a compound like 2-[4-amino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-6-(ethylamino)-2-hydroxy-cyclohexoxy]-5-methyl-4-(methylamino)tetrahydropyran-3,5-diol, with a complex structure, can be considerably affected by various factors. Here are some key points regarding its solubility:

  • Polarity: The presence of multiple hydroxyl groups and amino side chains in its structure suggests that this compound may exhibit a degree of polarity.
  • Water Solubility: Due to hydrophilic functionalities, it is likely that this compound is soluble in water, although this may vary depending on temperature and pH.
  • Solubility in Organic Solvents: Considering its hydrophilic nature, it might have limited solubility in organic solvents such as hexane or toluene but could dissolve better in alcohols or acetone.
  • pH Sensitivity: Being a complex amine, its solubility could also be influenced by the pH of the solution, where changes in pH might affect its charge state and solubility behavior.

In conclusion, while the precise solubility data may require experimental determination, general predictions suggest that this compound could show favorable solubility in polar solvents like water and lower solubility in non-polar organic solvents, making it versatile in potential applications. Understanding these properties is crucial for its effective use and formulation in various chemical processes.

Interesting facts

Interesting Facts about 2-[4-amino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-6-(ethylamino)-2-hydroxy-cyclohexoxy]-5-methyl-4-(methylamino)tetrahydropyran-3,5-diol

This compound, often abbreviated within scientific literature, is a fascinating example of complex organic chemistry, demonstrating the intricacies found in modern medicinal chemistry. Here are some intriguing facts about this compound:

  • Pharmacological Potential: This compound may exhibit unique pharmacological properties, including the potential for therapeutic uses in treating various medical conditions.
  • Structural Complexity: The multi-ring structure and the presence of various functional groups—like amino, hydroxyl, and ethylamino—highlight the compound's structural complexity, which is essential in determining its biological activity.
  • Synthesis Challenges: The synthesis of such a complex organic molecule often requires innovative synthetic strategies, including multiple steps and the use of protecting groups to ensure successful reactions.
  • Potential Derivatives: The structural features of this compound lend themselves to the design of derivatives, which can be explored for enhanced potency, selectivity, and reduced side effects.
  • Research Applications: It's of particular interest in the field of drug discovery and development, making it a subject of investigation in various research articles and studies.

As with many chemical compounds, understanding the interactions between its molecular components can provide insights into its mechanisms of action, potential side effects, and therapeutic applications. The field of medicinal chemistry continually seeks to better understand and utilize such compounds for the advancement of health sciences.

In summary, the compound's intricate design not only showcases the elegance of organic synthesis but also highlights the ongoing efforts in the scientific community to uncover new possibilities in pharmacology.

Synonyms
4-amino-3-{[3-amino-6-(aminomethyl)-3,4-dihydro-2h-pyran-2-yl]oxy}-6-(ethylamino)-2-hydroxycyclohexyl 3-deoxy-4-c-methyl-3-(methylamino)pentopyranoside
Prestwick0_001101
Prestwick1_001101
Prestwick2_001101
SPBio_003081
DTXSID30860699
BBL033848
STL372906
AKOS015961227
2-[4-amino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-6-(ethylamino)-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol
AC-13442
VS-12312
2-[(4-amino-3-{[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-6-(ethylamino)-2-hydroxycyclohexyl)oxy]-5-methyl-4-(methylamino)oxane-3,5-diol