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Methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate

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Identification
Molecular formula
C17H19N5O3
CAS number
260110-46-3
IUPAC name
methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate
State
State

At room temperature, this compound is typically found as a solid.

Melting point (Celsius)
253.00
Melting point (Kelvin)
526.00
Boiling point (Celsius)
425.00
Boiling point (Kelvin)
698.00
General information
Molecular weight
357.42g/mol
Molar mass
357.4220g/mol
Density
1.2400g/cm3
Appearence

Methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate is typically a crystalline solid. The crystals may vary in color from off-white to pale yellow. It has a characteristic odor, though this may not be strong or readily noticeable in all samples.

Comment on solubility

Solubility of Methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate

The solubility of methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate can be a critical factor in its application and effectiveness in various chemical processes. Understanding its solubility characteristics includes several important aspects:

  • Solvent Compatibility: This compound may show varying solubility in different solvents. For instance, it could be soluble in polar solvents like dimethyl sulfoxide (DMSO) or ethanol, while exhibiting lower solubility in non-polar solvents.
  • Temperature Effects: The solubility may increase with temperature, allowing for enhanced dissolution in certain applications, particularly in organic synthesis.
  • pH Dependence: The ionization status can significantly affect solubility. Under varying pH conditions, the solubility profile may change, making it crucial to consider pH in practical applications.
  • Concentration and Saturation: The compound's solubility limits can lead to saturation, where excess solute may precipitate, affecting its stability and utility.

As a result, it is essential to conduct thorough solubility tests under specific conditions to gain insights for optimum use. In the words of chemists, "The solubility is a key to unlocking the potential of chemical compounds"—highlighting its role in influencing reactivity, bioavailability, and overall performance.

Interesting facts

Interesting Facts about Methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate

Methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate is a fascinating compound, notable for its potential applications in various fields of chemistry and biology. Here are some intriguing aspects:

  • Pharmacological Potential: This compound belongs to a class of substances that may exhibit promising pharmacological activity. The presence of the benzimidazole moiety is particularly significant, as compounds in this class have been recognized for their roles in medicinal chemistry, displaying a wide range of biological effects.
  • Innovative Design: The incorporation of a carbamate functional group enhances the compound’s stability and solubility, opening the capability for varied reactivity. Scientists often modify organic structures to create molecules with desired properties, and this compound's design exemplifies this approach.
  • Structure-Activity Relationship: The unique structure of methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate serves as an important case study in understanding how molecular configuration influences biological activity. Exploring the structure-activity relationship of similar compounds can lead to the discovery of new therapeutic agents.
  • Importance of Cyanopentyl Chain: The 5-cyanopentyl chain is an intriguing feature that may play a crucial role in enhancing the compound's biological interactions. The cyanide group can induce unique chemical properties, making this compound an interesting subject of study for researchers focused on synthetic pathways and reactivity.
  • Environmental Considerations: Carbon-based compounds like this one are subjects of environmental research, especially concerning their potential biodegradability and toxicity. Understanding how these compounds interact with biological systems helps in assessing their safety and environmental impact.

In summary, methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate not only showcases intricate chemical design but also presents promising avenues for scientific research, particularly in medicinal chemistry. As with many compounds, further exploration of its properties could unravel new possibilities in drug development and environmental sciences.

Synonyms
Cypendazole
Cypendazol
28559-00-4
SL67GU815E
Methyl 1-(5-cyanopentylcarbamoyl)benzimidazol-2-ylcarbamate
DTXSID3041825
BAY-6233A
BAY-6233
DAM-18654
Carbamic acid, (1-(((5-cyanopentyl)amino)carbonyl)-1H-benzimidazol-2-yl)-, methyl ester
RefChem:1082801
DTXCID1021825
methyl N-(1-((5-cyanopentyl)carbamoyl)-1H-1,3-benzodiazol-2-yl)carbamate
249-082-1
Cypendazole [ISO]
methyl N-[1-(5-cyanopentylcarbamoyl)benzimidazol-2-yl]carbamate
BAY 6233
BAY 6233a
BAY-DAM 18654
EINECS 249-082-1
DAM 18654
BRN 0964051
UNII-SL67GU815E
CARBAMIC ACID, (1-((5-CYANOPENTYL)CARBAMOYL)BENZIMIDAZOL-2-YL)-, METHYL ESTER
SCHEMBL162357
SCHEMBL29430304
CHEBI:82059
Methyl (1-(((5-cyanopentyl)amino)carbonyl)-1H-benzimidazol-2-yl)carbamate
NS00028506
C18917
Q27155715
1-(5-CYANOPENTYL-CARBAMOYL)-2-(METHOXYCARBONYLAMINO)-BENZIMIDAZOLE
Methyl[1-[[(5-cyanopentyl)amino]carbonyl]-1H-benzimidazol-2-yl]carbamate
2-BENZIMIDAZOLECARBAMIC ACID, 1-((5-CYANOPENTYL)CARBAMOYL)-, METHYL ESTER
METHYL N-(1-(((5-CYANOPENTYL)AMINO)CARBONYL)-1H-BENZIMIDAZOL-2-YL)CARBAMATE
CARBAMIC ACID, N-(1-(((5-CYANOPENTYL)AMINO)CARBONYL)-1H-BENZIMIDAZOL-2-YL)-, METHYL ESTER