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531533-66-1

531533-66-1 structural image
Product Name: 3,5-DIIODO-2-[[[(3-PROPOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula: C18H16I2N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 610.2 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 609.89202 g/mol
Monoisotopic Mass 609.89202 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 552
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