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532386-89-3

532386-89-3 structural image
Product Name: 3,5-DIBROMO-2-[[[[(2-CHLOROPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula: C16H11Br2ClN2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 522.6 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 521.84743 g/mol
Monoisotopic Mass 519.84948 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 542
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