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72141-45-8

72141-45-8 structural image
Product Name: 1-(2-Pyridinyl)-4-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl) piperazine
Formula: C26H22F3N5O
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COMPUTED DESCRIPTORS

Molecular Weight 477.5 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 477.17764483 g/mol
Monoisotopic Mass 477.17764483 g/mol
Topological Polar Surface Area 61.4 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 706
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