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Smer3 (CAS 67200-34-4)

Cat. No. SC10254

⚠ This product is for research use only, not for human or veterinary use.

Chemical structure of Smer3

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Specifications

CAS Number 67200-34-4
IUPAC Name 13-oxa-10,12,14,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2,4,6,9,11,14-heptaen-8-one
Synonyms 9H-Indeno[1,2-b][1,2,5]oxadiazolo[3,4-E]pyrazin-9-one
Molecular Weight 224.17 g/mol
Molecular Formula C11H4N4O2
PubChem CID 568763
SMILES C1=CC=C2C(=C1)C3=NC4=NON=C4N=C3C2=O
Purity >98%
Shipping Condition Shipped under ambient temperature as non-hazardous chemical.

Description

Smer3 (CAS 67200-34-4) is a fused heterocyclic scaffold belonging to the indeno-oxadiazolopyrazine chemotype, incorporating a 1,2,5-oxadiazole (furazan) ring fused to an indenopyrazinone core. Its molecular formula is C₁₁H₄N₄O₂ with a molecular weight of 224.17 g/mol.

The compound features a planar, electron-deficient polycyclic aromatic framework arising from the fusion of benzene, cyclopentanone, pyrazine, and oxadiazole rings. This electron-poor character and rigid planarity suggest potential for π-stacking interactions and reactivity toward nucleophilic partners. The oxadiazole moiety contributes to the compound's electrophilic profile and may participate in covalent or non-covalent target engagement in biological systems.

  • Chemical biology tool compound for heterocyclic scaffold exploration
  • Building block or reference standard for medicinal chemistry and structure-activity relationship studies
  • Probe compound for investigating nitrogen-rich fused-ring interactions with biological targets
  • Reference compound in small-molecule library profiling

Each batch is analyzed by HPLC and ¹H NMR, with a Certificate of Analysis provided on shipment. Available from milligram to kilogram scale, with flexible packaging to meet R&D and scale-up requirements.

Documentation

✓ Certificate of Analysis (CoA) ✓ ¹H NMR Spectrum ✓ HPLC Chromatogram ✓ LC-MS (on request) ✓ MSDS / SDS

All analytical documentation is provided free of charge with every order. Raw spectral data files (NMR, HPLC, LC-MS) are also available on request — just mention it in your enquiry.

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