Products 2227480-51-3

CAS 2227480-51-3 appears in our catalog under these names: Ponatinib Impurity 3, Ponatinib N-Oxide. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 25mg.

Ponatinib Impurity 3
Chemat Brand
  • size: on request
  • Variants: 1
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Ponatinib N-Oxide
TRC
  • size: 25mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-[4-[(4-methyl-4-oxidopiperazin-4-ium-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide (CAS 2227480-51-3) is a chemical compound with the molecular formula C29H27F3N6O2 and a molecular weight of 548.6 g/mol. IUPAC name: 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-[4-[(4-methyl-4-oxidopiperazin-4-ium-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide. InChIKey: QLWXUMFIMUKGLE-UHFFFAOYSA-N.

Identity
Molecular formulaC29H27F3N6O2
Molecular weight548.6 g/mol
IUPAC name3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-[4-[(4-methyl-4-oxidopiperazin-4-ium-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide
InChIKeyQLWXUMFIMUKGLE-UHFFFAOYSA-N
SMILESCC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)CN3CC[N+](CC3)(C)[O-])C(F)(F)F)C#CC4=CN=C5N4N=CC=C5

Computed by PubChem (NCBI)

Synonyms: Ponatinib N-oxide, Ponatinib Impurity 3, QLWXUMFIMUKGLE-UHFFFAOYSA-N