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439141-72-7

439141-72-7 structural image
Product Name: KL002
Formula: C22H21IN2O3S
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COMPUTED DESCRIPTORS

Molecular Weight 520.4 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 520.03176 g/mol
Monoisotopic Mass 520.03176 g/mol
Topological Polar Surface Area 70.9 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 633
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