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535940-86-4

535940-86-4 structural image
Product Name: 2-[[[[[5-(4-BROMOPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]-3,5-DICHLORO-BENZOIC ACID
Formula: C19H11BrCl2N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 514.2 g/mol
XLogP3 6.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 511.90000 g/mol
Monoisotopic Mass 511.90000 g/mol
Topological Polar Surface Area 124 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 635
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