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Frovatriptan

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Identification
Molecular formula
C17H25NO3
CAS number
121679-13-8
IUPAC name
4-[3-[4-(1,1-dimethylpropyl)phenyl]-2-methyl-propyl]-2,6-dimethyl-morpholine
State
State

Frovatriptan is a solid at room temperature.

Melting point (Celsius)
227.00
Melting point (Kelvin)
500.15
Boiling point (Celsius)
204.00
Boiling point (Kelvin)
477.15
General information
Molecular weight
321.45g/mol
Molar mass
321.4510g/mol
Density
1.1250g/cm3
Appearence

Frovatriptan is typically found as a white to off-white crystalline powder.

Comment on solubility

Solubility of 4-[3-[4-(1,1-dimethylpropyl)phenyl]-2-methyl-propyl]-2,6-dimethyl-morpholine

The solubility characteristics of the compound 4-[3-[4-(1,1-dimethylpropyl)phenyl]-2-methyl-propyl]-2,6-dimethyl-morpholine, with the chemical formula C17H25NO3, highlight its unique structural features and their impact on solubility in various solvents.

Factors Influencing Solubility:

  • Molecular Structure: The compound contains a morpholine ring, which typically exhibits moderate solubility in polar solvents due to its heteroatoms.
  • Hydrophobic Chains: The presence of bulky hydrophobic groups, like the dimethylpropyl and phenyl moieties, may impede solubility in highly polar solvents like water but enhance solubility in organic solvents.
  • Temperature and Pressure: Solubility can vary significantly with changes in temperature and pressure, generally increasing with rising temperature for organic compounds.

Overall, 4-[3-[4-(1,1-dimethylpropyl)phenyl]-2-methyl-propyl]-2,6-dimethyl-morpholine is expected to exhibit:

  • Moderate to low solubility in water, due to its non-polar character from the bulky groups.
  • Higher solubility in organic solvents, such as ethanol or acetone, where the balance between polar and non-polar interactions is favorable.

In essence, the solubility profile of this compound invites an understanding of how its intricate molecular design interacts with various solvents, paving the way for practical applications in chemical formulations.

Interesting facts

Interesting Facts about 4-[3-[4-(1,1-dimethylpropyl)phenyl]-2-methyl-propyl]-2,6-dimethyl-morpholine

This compound, a member of the morpholine family, presents several fascinating aspects worth exploring. Morpholines, in general, are important in various fields, such as pharmaceuticals and agrochemicals, thanks to their unique structure and reactivity.

Key Features

  • Versatile Applications: The presence of the morpholine ring allows for diverse applications, particularly in medicinal chemistry where morpholines serve as core structures in numerous drugs.
  • Structural Complexity: This compound's intricate structure features multiple alkyl groups, which may influence its interaction with biological systems, increasing its potential as a drug candidate.
  • Dynamic Stereochemistry: Due to the various substituents on the morpholine ring, this compound can exhibit interesting stereochemical properties affecting its pharmacological profile.

Biological Significance

The modification of the morpholine ring through substitutions is a strategic approach in drug design. This compound might exhibit:

  • Improved selectivity for certain biological targets
  • Enhanced potency compared to simpler morpholine derivatives
  • Novel mechanisms of action that could lead to new therapeutic avenues

In summary, 4-[3-[4-(1,1-dimethylpropyl)phenyl]-2-methyl-propyl]-2,6-dimethyl-morpholine showcases the blending of structural diversity and potential utility in medicinal chemistry. As research evolves, compounds like this could reshape our understanding of drug molecules and their interactions within biological systems.

Synonyms
67467-83-8
Morpholine, 4-(3-(4-(1,1-dimethylpropyl)phenyl)-2-methylpropyl)-2,6-dimethyl-
2,6-dimethyl-4-[2-methyl-3-[4-(2-methylbutan-2-yl)phenyl]propyl]morpholine
78613-35-1
Morpholine,4-[3-[4-(1,1-dimethylpropyl)phenyl]-2-methylpropyl]-2,6-dimethyl-,(2R,6S)-rel-
Ro 14-4767-002
2,6-dimethyl-4-{2-methyl-3-[4-(2-methylbutan-2-yl)phenyl]propyl}morpholine
SCHEMBL933541
DTXSID80861010
MQHLMHIZUIDKOO-UHFFFAOYSA-N
78613-35-1 (free base)
BCP16329
STL451077
AKOS030228146
NS00077906
2,6-dimethyl-4-(2-methyl-3-(4-(tert-pentyl)phenyl)propyl)morpholine
4-[3-(p-tert.-amyl-phenyl)-2-methyl-propyl]-2,6-dimethylmorpholine
4-[3-(p-tert.amyl-phenyl)-2-methyl-propyl]-2,6-dimethyl-morpholine
num; Loceryl; Ro 14-4767; Ro-14-4767; Ro14-4767; Amorolfina