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3-(2-morpholinoethyl)-5-phenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one

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Identification
Molecular formula
C16H19N3O2
CAS number
123456-78-9
IUPAC name
3-(2-morpholinoethyl)-5-phenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one
State
State

At room temperature, this compound is a solid. It is typically handled in powder or crystalline form.

Melting point (Celsius)
182.50
Melting point (Kelvin)
455.65
Boiling point (Celsius)
525.00
Boiling point (Kelvin)
798.15
General information
Molecular weight
290.34g/mol
Molar mass
290.3420g/mol
Density
1.3245g/cm3
Appearence

This compound is typically a white to off-white crystalline powder. The solid is finely divided and may have a slight chemical or aromatic odor depending on purity and crystal size.

Comment on solubility

Solubility of 3-(2-morpholinoethyl)-5-phenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one

The solubility of 3-(2-morpholinoethyl)-5-phenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one in various solvents can reveal much about its chemical behavior and potential applications. Generally, the solubility of organic compounds like this one is influenced by several factors:

  • Polarity: This compound contains both polar (morpholino group) and non-polar (phenyl group) elements, suggesting it may exhibit variable solubility in polar and non-polar solvents.
  • Hydrogen bonding: The presence of a morpholino group indicates that it may participate in hydrogen bonding, enhancing its solubility in protic solvents such as water or alcohols.
  • Dielectric constant: A solvent's dielectric constant can significantly impact solubility; compounds such as this may dissolve well in solvents with moderate to high dielectric constants.

Typically, compounds like C₁₈H₁₈N₄O are more soluble in organic solvents such as ethanol, DMSO, or dimethylformamide than in water, due to their mixed polarity. The actual solubility can vary, though, and is often best determined empirically. Therefore, obtaining the specific solubility data through experimental means is essential for practical applications.

In summary, while predicting the solubility behavior of this compound can be guided by its structure, experiments will provide the definitive answers.

Interesting facts

Interesting Facts About 3-(2-morpholinoethyl)-5-phenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one

This intriguing compound is notable for its unique bicyclic structure and the presence of a morpholino group, giving it significant importance in medicinal chemistry. Here are some interesting aspects:

  • Structure and Stability: The bicyclic configuration contributes to the compound's stability and potential reactivity, making it an interesting candidate for various chemical transformations.
  • Pharmacological Potential: Compounds with similar structures have been studied for their biological activity. They may exhibit properties such as anti-inflammatory, analgesic, or even anticancer effects, highlighting the importance of this compound in drug development.
  • Flexibility in Design: The morpholino group allows for further modifications, which can lead to the synthesis of analogs with varied properties, enabling researchers to tailor compounds for specific therapeutic outcomes.
  • Chemical Synthesis: The synthesis of this compound can involve multiple reactions, showcasing the versatility and creativity required in synthetic organic chemistry.
  • Interdisciplinary Applications: Due to its structural features, this compound may find applications beyond pharmaceuticals, potentially in agrochemicals or materials science, illustrating the broad relevance of chemical research.

In conclusion, 3-(2-morpholinoethyl)-5-phenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one stands out for its potential therapeutic applications and unique chemical properties, making it a fascinating subject for ongoing research and exploration in the field of chemistry.

Synonyms
AG 274
21769-53-9
BRN 0928886
4-(2-Morpholinoethyl)-2-phenyl-3,4-diazabicyclo(4.1.0)hept-2-en-5-one
Morpholinoethyl-4 oxo-5 phenyl-2 diaza-3,4 bicyclo(4.1.0)heptene-2 [French]
3,4-DIAZABICYCLO(4.1.0)HEPT-2-EN-5-ONE, 4-(2-MORPHOLINOETHYL)-2-PHENYL-
Morpholinoethyl-4 oxo-5 phenyl-2 diaza-3,4 bicyclo(4.1.0)heptene-2
RefChem:270752
DTXSID30944382
3-[2-(Morpholin-4-yl)ethyl]-5-phenyl-3,4-diazabicyclo[4.1.0]hept-4-en-2-one