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840476-88-2

840476-88-2 structural image
Product Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-4-(4-methylphenyl)phthalazin-1-one
Formula: C29H29N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 451.6 g/mol
XLogP3 5.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 451.22597718 g/mol
Monoisotopic Mass 451.22597718 g/mol
Topological Polar Surface Area 53 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 743
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