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622800-36-6

622800-36-6 structural image
Product Name: (Z)-3-oxo-2-(pyridin-3-ylmethylene)-2,3-dihydrobenzofuran-6-yl benzo[d][1,3]dioxole-5-carboxylate
Formula: C22H13NO6
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COMPUTED DESCRIPTORS

Molecular Weight 387.3 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 387.07428713 g/mol
Monoisotopic Mass 387.07428713 g/mol
Topological Polar Surface Area 84 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 678
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