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72141-43-6

72141-43-6 structural image
Product Name: Piperazine, 1-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-
Formula: C21H19F3N4O
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COMPUTED DESCRIPTORS

Molecular Weight 400.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 400.15109573 g/mol
Monoisotopic Mass 400.15109573 g/mol
Topological Polar Surface Area 57.3 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 559
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes