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311774-43-3

311774-43-3 structural image
Product Name: 2-amino-1-(4-bromophenyl)-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
Formula: C24H21BrFN3O
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COMPUTED DESCRIPTORS

Molecular Weight 466.3 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 465.08520 g/mol
Monoisotopic Mass 465.08520 g/mol
Topological Polar Surface Area 70.1 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 823
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes