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764667-65-4

764667-65-4 structural image
Product Name: (2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-one
Formula: C16H12F6N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 406.28 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 4
Exact Mass 406.08644461 g/mol
Monoisotopic Mass 406.08644461 g/mol
Topological Polar Surface Area 68.1 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 606
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

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