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2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine

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Identification
Molecular formula
C13H11N5O
CAS number
140444-94-6
IUPAC name
2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine
State
State

This compound is a solid at room temperature. It is typically stable under standard conditions.

Melting point (Celsius)
260.00
Melting point (Kelvin)
533.15
Boiling point (Celsius)
150.00
Boiling point (Kelvin)
423.15
General information
Molecular weight
267.28g/mol
Molar mass
267.2820g/mol
Density
1.3200g/cm3
Appearence

2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine typically appears as a crystalline solid. The color can vary from white to off-white, depending on purity and specific form.

Comment on solubility

Solubility of 2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine

The solubility of 2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine (C13H11N5O) can be influenced by a variety of factors due to its complex structure. Understanding its solubility properties is crucial for applications in pharmaceutical and chemical research.

Factors Affecting Solubility

  • Polarity: The presence of multiple nitrogen atoms and a carboxamidine group can contribute to the polar characteristics of this compound, which may enhance its solubility in polar solvents.
  • Hydrophilicity vs. Hydrophobicity: While the pyridine and benzimidazole moieties provide some degree of hydrophobicity, the carboxamidine group introduces hydrophilic interactions, potentially increasing its solubility in water.
  • Temperature: Solubility is temperature-dependent; as the temperature increases, the kinetic energy of the molecules also increases, often leading to higher solubility.

Experimental studies are required to determine the solubility limits of this compound under various conditions. It is also important to investigate:

  • The solubility in organic solvents like DMSO or ethanol
  • Stability in aqueous environments
  • Interactions with other solutes which may affect solubility

In conclusion, while theoretical approaches can provide some initial insights, actual measurements are essential to obtain accurate data on the solubility of 2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine. Factors such as polarity, structure, and environmental conditions all play critical roles in its solubility behavior.

Interesting facts

Interesting Facts about 2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine

2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine is a fascinating compound that is of significant interest in the field of medicinal chemistry. Here are some intriguing points about this compound:

  • Potential Anticancer Activity: Researchers have indicated that compounds similar to this one may exhibit promising anticancer properties, making them candidates for future cancer therapies.
  • Complex Structure: The unique combination of the pyridine and benzimidazole moieties in its structure contributes to its potential biological activity, enhancing its interaction with various biological targets.
  • Research Applications: This compound has been explored for its role as a *kinase inhibitor*, which can have implications in treating diseases characterized by abnormal kinase activity, such as cancer and some neurodegenerative disorders.
  • Pharmacophore Characteristics: It contains features that are considered ideal for developing potent drugs, such as hydrogen bond donors and acceptors, contributing to its ability to interact favorably with target proteins.
  • Impact on Drug Design: The insights gained from this compound can aid in the design of new derivatives that may offer improved efficacy or reduced side effects, showcasing the importance of structure-activity relationships in drug development.

In conclusion, 2-(2-oxo-1H-pyridin-3-yl)-3H-benzimidazole-5-carboxamidine is more than just a chemical entity; it embodies the potential for pharmaceutical innovation and therapeutic advancements. As research continues, the exploration of this compound may open doors to novel treatment strategies.

Synonyms
2-(2-Oxo-1,2-dihydropyridin-3-yl)-1H-benzo[d]imidazole-6-carboximidamide
348635-97-2
1ghv
1ghz
1gi7
SCHEMBL4324187
PD059257
NS00069135