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477851-81-3

477851-81-3 structural image
Product Name: 7-(4-BENZHYDRYLPIPERAZINO)-2,4-BIS(TRIFLUOROMETHYL)[1,8]NAPHTHYRIDINE
Formula: C27H22F6N4
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COMPUTED DESCRIPTORS

Molecular Weight 516.5 g/mol
XLogP3 6.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 4
Exact Mass 516.17486569 g/mol
Monoisotopic Mass 516.17486569 g/mol
Topological Polar Surface Area 32.3 Ų
Heavy Atom Count 37
Formal Charge 0
Complexity 707
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