Des(N,N-Dimethylprop-2-enyl-1-Amine) Afatinib

Analyte Name

Des(N,N-Dimethylprop-2-enyl-1-Amine) Afatinib

CAS Number

2223677-60-7

Molecular Formula

C19H16ClFN4O3

Molecular Weight

402.81

Accurate Mass

402.09

SMILES

FC(C=C1)=C(Cl)C=C1NC2=NC=NC3=CC(O[C@H]4COCC4)=C(NC([H])=O)C=C32

InChI

InChI=1S/C19H16ClFN4O3/c20-14-5-11(1-2-15(14)21)25-19-13-6-17(24-10-26)18(7-16(13)22-9-23-19)28-12-3-4-27-8-12/h1-2,5-7,9-10,12H,3-4,8H2,(H,24,26)(H,22,23,25)/t12-/m1/s1

IUPAC

(R)-N-(4-((3-chloro-4-fluorophenyl)amino)-7-((tetrahydrofuran-3-yl)oxy)quinazolin-6-yl)formamide

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)