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4-[(4-allyl-2,5-dimethyl-piperazin-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide

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Identification
Molecular formula
C27H35N3O2
IUPAC name
4-[(4-allyl-2,5-dimethyl-piperazin-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide
State
State

At room temperature, this compound is expected to be a solid due to its relatively high molecular weight and complex structure. It should be handled in a well-ventilated area, using suitable safety procedures for organic compounds.

Melting point (Celsius)
168.00
Melting point (Kelvin)
441.15
Boiling point (Celsius)
555.15
Boiling point (Kelvin)
828.15
General information
Molecular weight
409.55g/mol
Molar mass
409.5490g/mol
Density
1.1000g/cm3
Appearence

The compound likely appears as a solid at room temperature, given the structure typical of benzamide derivatives. However, specific details about its coloration or crystalline form are not commonly documented, hence the appearance might vary based on purity and sample handling.

Comment on solubility

Solubility of 4-[(4-allyl-2,5-dimethyl-piperazin-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide

The solubility of the compound with the formula C27H35N3O2 is influenced by several factors due to its complex structure. Understanding its solubility behavior can be crucial for applications in various fields:

  • Polarity: The presence of functional groups, such as the hydroxy group and the piperazine moiety, suggests potential hydrogen bonding, which may enhance solubility in polar solvents.
  • Hydrophobic vs. Hydrophilic: The large aromatic and aliphatic portions of the compound indicate that it may exhibit hydrophobic characteristics, leading to lower solubility in water.
  • Solvent Compatibility: It is likely to be more soluble in organic solvents, such as dichloromethane or ethanol, rather than in aqueous solutions, due to the structural components.

Consequently, it is essential to conduct experimental assessments to determine the exact solubility profile. As a general guideline, one might consider that:

  1. Testing in various solvent systems is recommended.
  2. Analysis of temperature effects can provide insights into solubility variations.
  3. Evaluation of pH impact can be pivotal, especially with compounds containing acidic or basic functional groups.

By examining these aspects, a clearer picture of the compound's solubility can evolve, promoting effective utilization in chemical applications and formulations.

Interesting facts

Interesting Facts about 4-[(4-allyl-2,5-dimethyl-piperazin-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide

This compound is a fascinating example of modern organic chemistry, showcasing the complexity and versatility that can be achieved through structural modifications. Here are some intriguing points about this compound:

  • Pharmaceutical Potential: The structure suggests potential biological activities. Compounds with piperazine rings are often found in various pharmaceutical applications. This compound may be explored for its efficacy as an analgesic or an anxiolytic.
  • Combining Functional Groups: The presence of both hydroxyphenyl and benzamide groups highlights the ability of the compound to engage in various chemical interactions. This can enhance solubility in biological systems, improving bioavailability.
  • Understanding Structure-Activity Relationship (SAR): The intricate design of this compound allows chemists to study how different segments of the molecule contribute to its overall activity. By modifying specific parts, scientists can enhance desired properties while minimizing adverse effects.
  • Allyl Substituent: The allyl group in the structure not only contributes to the overall reactivity of the compound but may also provide a means to undergo further transformations, making it a versatile building block in synthetic organic chemistry.
  • Dimethyl Piperazine Role: The inclusion of a dimethyl piperazine moiety can influence the compound’s pharmacokinetic properties, such as lipophilicity and receptor binding affinity, making it an impactful area of research.

The exploration of such complex compounds is essential for advancing pharmaceutical sciences and enhancing our understanding of molecular interactions in biological systems. As we learn more about compounds like this one, we pave the way for innovative therapies that could transform medical treatments.

Synonyms
CHEMBL303855
4-[(4-Allyl-2,5-dimethyl-piperazin-1-yl)-(3-hydroxy-phenyl)-methyl]-N,N-diethyl-benzamide
SCHEMBL4576398
LBLDMHBSVIVJPM-UHFFFAOYSA-N
FGA83650
BDBM50039028
4-[(2,5-dimethyl-4-prop-2-enylpiperazin-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethylbenzamide
Q4836836
Piperazine, 2,5-dimethyl-1-[[.alpha.-hydroxyphenyl-4-(N,N-diethylamino)
4-[(4-Allyl-2,5-dimethyl-1-piperazinyl)(3-hydroxyphenyl)methyl]-N,N-diethylbenzamide #