Product Information
Name:N-Desmethyl Regorafenib (Pyridine)-N-oxide
Controlled Product
Synonyms:
- 4-[4-[[[[4-Chloro-3-(trifluoromethyl)phenyl]amino]carbonyl]amino]-3-fluorophenoxy]-2-pyridinecarboxamide 1-Oxide
- Regorafenib metabolite M5
Brand:TRC
Description:Stability Light Sensitive
Applications N-Desmethyl Regorafenib (Pyridine)-N-oxide is a synthetic metabolite of Regorafenib (R143000) and is used for treatment and prevention of cancer.
References Wilhelm, S.: PCT Int. Appl. WO 2011130728 A1 20111020. Oct 20, 2011
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Chemical properties
Molecular weight:484.79
Formula:C20H13ClF4N4O4
Color/Form:Neat
InChI:InChI=1S/C20H13ClF4N4O4/c21-14-3-1-10(7-13(14)20(23,24)25)27-19(31)28-16-4-2-11(8-15(16)22)33-12-5-6-29(32)17(9-12)18(26)30/h1-9H,(H2,26,30)(H2,27,28,31)
InChI key:InChIKey=JPEWXTSDCNCZOD-UHFFFAOYSA-N
SMILES:NC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c(F)c2)cc[n+]1[O-]
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