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478261-79-9

478261-79-9 structural image
Product Name: 11-(TRIFLUOROMETHYL)-9H-PYRIMIDO[1',2':2,3][1,2,4]TRIAZINO[6,5-C]CINNOLIN-9-ONE
Formula: C13H5F3N6O
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COMPUTED DESCRIPTORS

Molecular Weight 318.21 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 0
Exact Mass 318.04769329 g/mol
Monoisotopic Mass 318.04769329 g/mol
Topological Polar Surface Area 82.1 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 733
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