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CAS 1239879-72-1

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9-Bromo-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,7-a]benzimidazole

Description:
9-Bromo-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,7-a]benzimidazole is a heterocyclic compound characterized by its complex bicyclic structure, which incorporates both diazepine and benzimidazole moieties. The presence of a bromine atom at the 9-position contributes to its reactivity and potential biological activity. This compound typically exhibits properties such as moderate solubility in organic solvents and limited solubility in water, which is common for many nitrogen-containing heterocycles. Its structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting neurological or psychiatric disorders, given the diazepine framework's historical association with anxiolytic and sedative effects. The compound's synthesis and characterization would involve standard organic chemistry techniques, including NMR and mass spectrometry for structural confirmation. Additionally, its safety and handling would require standard precautions due to the presence of bromine, which can be hazardous. Overall, 9-Bromo-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,7-a]benzimidazole represents a unique scaffold for further research and development in drug discovery.
Formula:C11H12BrN3
InChI:InChI=1S/C11H12BrN3/c12-8-1-2-9-10(7-8)15-6-5-13-4-3-11(15)14-9/h1-2,7,13H,3-6H2
InChI key:InChIKey=UCDIQYIQNGIXDE-UHFFFAOYSA-N
SMILES:BrC=1C=C2N3C(=NC2=CC1)CCNCC3
Synonyms:
  • 9-Bromo-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,7-a]benzimidazole
  • 1H-[1,4]Diazepino[1,7-a]benzimidazole, 9-bromo-2,3,4,5-tetrahydro-
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