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Benzyl aminophenyl aminocarbamate

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Identification
Molecular formula
C21H20N2O4
CAS number
22825-42-1
IUPAC name
benzyl N-[[4-[(2-hydroxyphenyl)carbamoyl]phenyl]methyl]carbamate
State
State

At room temperature, this compound exists as a solid. It is stable under normal conditions but should be stored in a cool, dry place to prevent any decomposition or humidity uptake.

Melting point (Celsius)
130.00
Melting point (Kelvin)
403.15
Boiling point (Celsius)
390.00
Boiling point (Kelvin)
663.15
General information
Molecular weight
335.37g/mol
Molar mass
335.3690g/mol
Density
1.3000g/cm3
Appearence

This compound is typically crystalline and may appear as a white to off-white powder. The appearance can slightly vary depending on purity and formulation, but it usually presents as a solid at room temperature.

Comment on solubility

Solubility of Benzyl N-[[4-[(2-hydroxyphenyl)carbamoyl]phenyl]methyl]carbamate

The solubility of benzyl N-[[4-[(2-hydroxyphenyl)carbamoyl]phenyl]methyl]carbamate (C21H20N2O4) can be influenced by several factors, reflecting its complex molecular structure. Here are some important points to consider:

  • Polarity: The presence of hydroxyl groups and amide functionalities in the compound suggests it may exhibit polar characteristics, which influences its solubility in polar solvents like water.
  • Solvent Interaction: It is likely to be more soluble in organic solvents such as ethanol or dimethyl sulfoxide (DMSO), which can stabilize the molecule through hydrogen bonding.
  • Temperature Dependency: Solubility can increase with temperature, a common behavior seen in many organic compounds. This is critical for applications that require higher temperatures.
  • pH Sensitivity: If the hydroxy group can participate in protonation/deprotonation, the solubility may vary significantly with pH, which should be considered in biological or pharmaceutical contexts.

Understanding the solubility profile not only aids in practical application but also in predictive modeling for how this compound may behave in different environments. Given these complexities, experiments often yield the most accurate and useful data for determining solubility in practical settings.

Interesting facts

Exploring Benzyl N-[[4-[(2-hydroxyphenyl)carbamoyl]phenyl]methyl]carbamate

Benzyl N-[[4-[(2-hydroxyphenyl)carbamoyl]phenyl]methyl]carbamate is a fascinating compound that belongs to the class of carbamates, which are widely recognized for their diverse applications in both medicinal and agricultural chemistry. This compound's structure is particularly interesting due to its combination of functional groups that contribute to its potential biological activity.

Key Characteristics

  • Versatile Applications: Compounds like this one are often investigated for their roles in drug development. They can exhibit various biological activities, including anti-inflammatory and anticancer properties.
  • Structural Complexity: The presence of multiple aromatic rings and functional groups such as hydroxyl (-OH) and carbamate makes this compound a subject of interest for studying structure-activity relationships.
  • Drug Design: The benzyl group and the carbamate moiety can enhance the lipophilicity and bioavailability of the compounds, tailoring them for specific therapeutic targets.

As a scientist, one might consider the following during research:

  • Synthetic Pathways: Investigating the synthetic routes to prepare this compound can reveal novel methodologies that can be applied to create analogs.
  • Biological Studies: Conducting in vitro and in vivo studies helps uncover the mechanisms of action and potential side effects, important for evaluation in drug development.
  • Collaboration Across Disciplines: The complexity of such compounds often requires interdisciplinary teamwork, combining organic chemistry, pharmacology, and computational modeling.

In conclusion, the unique structure of benzyl N-[[4-[(2-hydroxyphenyl)carbamoyl]phenyl]methyl]carbamate provides a rich foundation for exploration in the field of chemistry. As researchers delve deeper into its properties and applications, they may unlock new insights that could lead to innovative therapeutic solutions.

Synonyms
HDInhib_000008
EN300-37387754
benzyl N-({4-[(2-hydroxyphenyl)carbamoyl]phenyl}methyl)carbamate
1022594-70-2