| Identification | Back Directory | [Name]
4-Hydroxy 4-Dedimethylamino Afatinib | [CAS]
2121530-37-6 | [Synonyms]
Afatinib 4-Hydroxy Analog
Afatinib Maleate Acid Impurity 3
4-Hydroxy 4-Dedimethylamino Afatinib
2-Butenamide, N-[4-[(3-chloro-4-fluorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4-hydroxy-, (2E)-
(2E)?-N-?[4-?[(3-?chloro-?4-?fluorophenyl)?amino]?-?7-?[[(3S)?-?tetrahydro-?3-?furanyl]?oxy]?-?6-?quinazolinyl]?-?4-?hydroxy-2-?butenamide
Afatinib impurity 2/4-Hydroxy 4-Dedimethylamino Afatinib/(2E)-N-[4-[(3-chloro-4-fluorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4-hydroxy-2-butenamide | [Molecular Formula]
C22H20ClFN4O4 | [MOL File]
2121530-37-6.mol | [Molecular Weight]
458.87 |
| Chemical Properties | Back Directory | [Boiling point ]
714.713±60.00 °C(Press: 760.00 Torr)(predicted) | [density ]
1.484±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) | [pka]
11.521±0.43(predicted) | [InChIKey]
XZMUSENASPIMAT-YUKKFKLSSA-N | [SMILES]
N(C1C=CC(=C(C=1)Cl)F)C1=NC=NC2C=C(C(=CC=21)NC(=O)/C=C/CO)O[C@@H]1COCC1 |
| Hazard Information | Back Directory | [Uses]
(2E)?-N-?[4-?[(3-?chloro-?4-?fluorophenyl)?amino]?-?7-?[[(3S)?-?tetrahydro-?3-?furanyl]?oxy]?-?6-?quinazolinyl]?-?4-?hydroxy-2-?butenamide is an impurity of Afatinib (A355300), an aminocrotonylamino-substituted quinazoline derivative used for treating cancer and diseases of the respiratory tract, lungs, gastrointestinal tract, bile duct, and gallbladder. |
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