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489416-55-9

489416-55-9 structural image
Product Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-[1,2,4]triazolo[3,4-a]phthalazin-6-amine
Formula: C20H20N6O
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COMPUTED DESCRIPTORS

Molecular Weight 360.4 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 360.16985928 g/mol
Monoisotopic Mass 360.16985928 g/mol
Topological Polar Surface Area 76.7 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 481
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