Products 1398312-64-5

CAS 1398312-64-5 appears in our catalog under these names: Afatinib oxalate, Afatinib (oxalate). Offered by: TargetMol, MedChemExpress. Available pack sizes: 25mg, 50mg, 100mg, Get quote.

Structural formula: {0} (CAS {1})

(E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide;oxalic acid (CAS 1398312-64-5) is a chemical compound with the molecular formula C28H29ClFN5O11 and a molecular weight of 666.0 g/mol. IUPAC name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide;oxalic acid. InChIKey: NHTYOYNDYHAMAE-IACUOYJGSA-N.

Identity
Molecular formulaC28H29ClFN5O11
Molecular weight666.0 g/mol
IUPAC name(E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide;oxalic acid
InChIKeyNHTYOYNDYHAMAE-IACUOYJGSA-N
SMILESCN(C)C/C=C/C(=O)NC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)O[C@H]4CCOC4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Computed by PubChem (NCBI)