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877782-45-1

877782-45-1 structural image
Product Name: N-[(3-bromophenyl)methyl]-5-chloro-N-(1,1-dioxothiolan-3-yl)-3-methyl-1-benzofuran-2-carboxamide
Formula: C21H19BrClNO4S
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COMPUTED DESCRIPTORS

Molecular Weight 496.8 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 494.99067 g/mol
Monoisotopic Mass 494.99067 g/mol
Topological Polar Surface Area 76 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 714
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes