Afatinib Dimaleate

Analyte Name

Afatinib Dimaleate

CAS Number

850140-73-7

Molecular Formula

C24 H25 Cl F N5 O3 . 2 C4 H4 O4

Molecular Weight

718.08

Accurate Mass

717.1849

SMILES

CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]4CCOC4.OC(=O)\C=C/C(=O)O.OC(=O)\C=C/C(=O)O

InChI

InChI=1S/C24H25ClFN5O3.2C4H4O4/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15, 2*5-3(6)1-2-4(7)8/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29), , /m0../s1, 2*1-2H,(H,5,6)(H,7,8)/b4-3+, 2*2-1-/t16-

IUPAC

(Z)-but-2-enedioic acid;(E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide

Alternate CAS Number

Free base: 439081-18-2

Storage Temperature

+5°C

Shipping Temperature

Room Temperature

Country of Origin

GERMANY

Product Type

API

Product Format

Neat

API Family

Afatinib Dimaleate