4-(3-chloro-4-fluoroanilino)-6-(3-morpholin-4-ylpropoxy)-1H-quinazolin-7-one
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4-(3-chloro-4-fluoroanilino)-6-(3-morpholin-4-ylpropoxy)-1H-quinazolin-7-one
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CAS No:
847949-49-9
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Formula:
C21H22ClFN4O3
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Chemical Name:
4-(3-chloro-4-fluoroanilino)-6-(3-morpholin-4-ylpropoxy)-1H-quinazolin-7-one
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Synonyms:
4-(3'-chloro-4'-fluoroanilino)-7-hydroxy-6-(3-morpholinopropoxy)quinazoline; 7-Quinazolinol,4-[(3-chloro-4-fluorophenyl)amino]-6-[3-(4-morpholinyl)propoxy]; 4-[(3-Chloro-4-fluorophenyl)amino]-6-[3-(4-morpholinyl)propoxy]-7-quinazolinol; O-Demethyl-Gefitinib; O-Desmethyl Gefitinib;
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CAS No:
4-(3-chloro-4-fluoroanilino)-6-(3-morpholin-4-ylpropoxy)-1H-quinazolin-7-one Basic Attributes
432.87600
432.1364464
53LPA3P6SI
DTXSID50461102
2934999090
Characteristics
79.74000
3.98350
1.386g/cm3
117-120ºC
606.4ºC at 760 mmHg
320.5ºC
1.65
-20ºC Freezer
Computed Properties
Molecular Weight:432.9
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:432.1364464
Monoisotopic Mass:432.1364464
Topological Polar Surface Area:79.7
Heavy Atom Count:30
Complexity:531
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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