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Bisacodyl

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Identification
Molecular formula
C22H19NO4
CAS number
603-50-9
IUPAC name
5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid
State
State

At room temperature, bisacodyl is typically a solid powder.

Melting point (Celsius)
131.00
Melting point (Kelvin)
404.00
Boiling point (Celsius)
421.00
Boiling point (Kelvin)
694.00
General information
Molecular weight
362.40g/mol
Molar mass
362.4130g/mol
Density
1.3000g/cm3
Appearence

Bisacodyl appears as a white to off-white crystalline powder. It is odorless or may have a faint odor characteristic to phenolic compounds.

Comment on solubility

Solubility of 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid (C22H19NO4)

The solubility of 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid is influenced by its complex molecular structure, which includes multiple functional groups that can interact with solvents. Here are some key points regarding its solubility:

  • Polar Characteristics: The presence of hydroxyl groups (-OH) in the molecule suggests that it may exhibit polar characteristics, which can enhance solubility in polar solvents like water.
  • Hydrophobic Interactions: The aromatic rings within the structure may introduce hydrophobic regions, potentially limiting solubility in polar solvents.
  • pH Dependency: This compound's solubility might also vary significantly with pH due to its acidic and basic functional groups, impacting its ionization state. At different pH levels, it may exist in various ionic forms that are more or less soluble.
  • Solvent Choice: It could be soluble in organic solvents such as ethanol or DMSO, which can interact more effectively with its hydrophobic segments.

In conclusion, while the solubility of 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid can be favorable in certain solvents, it is crucial to consider its structural attributes, the nature of the solvent, and the surrounding pH conditions. Understanding these factors will aid in predicting its behavior in various applications.

Interesting facts

Interesting Facts about 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid

The compound 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid is a fascinating example of a molecule that bridges the worlds of organic chemistry and medicinal chemistry. Here are some of the compelling attributes that make this compound noteworthy:

  • Dual Functionality: This compound features both an amine and a carboxylic acid functional group, granting it unique properties that can be leveraged in various chemical reactions.
  • Bioactivity: Due to its structure, it shows potential biological activity, shedding light on how chemical modifications can influence pharmacological properties.
  • Synthetic Versatility: The synthesis of this compound can serve as an excellent case study in multi-step organic synthesis, emphasizing the importance of protecting groups and selective reactions.
  • Structure-Activity Relationship (SAR): Investigating this compound allows chemists to explore the relationship between chemical structure and biological activity—an essential aspect of drug discovery.
  • Applications in Cancer Research: Compounds with similar structures are often investigated for their potential anti-cancer properties, representing how organic compounds can be tailored toward therapeutic applications.

As one delves deeper into the synthesis and applications of 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid, it becomes clear that this compound is not just a mere collection of atoms; it is a testament to the creativity and ingenuity of chemists. The amalgamation of its functional groups suggests numerous pathways for further research, especially in the fields of medicinal chemistry and biosynthesis.

In the well-known words of Marie Curie, "Nothing in life is to be feared, it is only to be understood." This compound serves as a reminder that with every new molecule, there exists a tapestry of knowledge waiting to be unraveled.

Synonyms
lavendustin b
125697-91-8
5-(bis(2-hydroxybenzyl)amino)-2-hydroxybenzoic acid
5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid
UNII-7T53EGQ52Z
7T53EGQ52Z
Benzoic acid, 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-
5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid
DTXSID40154854
5-(Bis((2-hydroxyphenyl)methyl)amino)-2-hydroxybenzoic acid
Benzoic acid, 5-(bis((2-hydroxyphenyl)methyl)amino)-2-hydroxy-
5-(bis((2-hydroxyphenyl)methyl)amino)-2-hydroxybenzoate
5-{bis[(2-hydroxyphenyl)methyl]amino}-2-hydroxybenzoate
lavendustin B?
CHEMBL485258
DTXCID1077345
SCHEMBL13228056
CHEBI:213920
GLXC-10652
BCP20779
BDBM50025606
HSCI1_000118
AKOS030239802
CCG-208626
FL24862
SMP2_000233
NCGC00163670-01
AC-38077
BS-49228
DA-74914
HY-108935
CS-0032024
L0312
N17046
5-Amino-(N,N'-bis-2-hydroxybenzyl)salicylic acid
N,N-bis(2'-Hydroxybenzyl)-3-aminosalicylic acid
SR-05000002160
SR-05000002160-2
BRD-K33781562-001-02-7
Q27268819
878-714-4