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866149-05-5

866149-05-5 structural image
Product Name: 2-AMINO-3-(((E)-[3-(2-PYRIMIDINYLOXY)PHENYL]METHYLIDENE)AMINO)-6-(TRIFLUOROMETHYL)-4(3H)-PYRIMIDINONE
Formula: C16H11F3N6O2
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COMPUTED DESCRIPTORS

Molecular Weight 376.29 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 4
Exact Mass 376.08955810 g/mol
Monoisotopic Mass 376.08955810 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 643
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes