N-De[2-(methylsulfonyl)ethyl] Lapatinib

CAS: 697299-82-4

Ref. TR-D231270

Product Information

• Name: N-De[2-(methylsulfonyl)ethyl] Lapatinib
• Synonyms: 6-[5-(Aminomethyl)-2-furanyl]-N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-4-quinazolinamine, [6-(5-Aminomethylfuran-2-yl)quinazolin-4-yl][3-chloro- 4-(3-fluorobenzyloxy)phenyl]amine
• Brand: TRC
• Description: Applications A reactive metabolite of Lapatinib (L175800) which is associated with various drug toxicities. Lapatinib is metabolized mainly by P450 3A4 to form O- and N-dealkylated metabolites.References He, K., et al.: Chem. Res. Toxicol., 11, 252 (1998), Rusnuk, D., et al.: Cancer Res., 61, 7196 (2001), Li, X., et al.: Drug Metab. Dispos., 37, 1242 (2009),

Chemical properties

• Molecular weight: 474.91
• Formula: C₂₆H₂₀ClFN₄O₂
• Color/Form: Neat
• InChI: InChI=1S/C26H20ClFN4O2/c27-22-12-19(5-8-25(22)33-14-16-2-1-3-18(28)10-16)32-26-21-11-17(4-7-23(21)30-15-31-26)24-9-6-20(13-29)34-24/h1-12,15H,13-14,29H2,(H,30,31,32)
• InChI key: InChIKey=DVCCCQNKIYNAKB-UHFFFAOYSA-N
• SMILES: Cc1cnc2ccc3c(nc(N)n3C)c2n1