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530134-45-3

530134-45-3 structural image
Product Name: 3-[[[(3,5-DICHLORO-2-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID
Formula: C17H14Cl2N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 413.3 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 412.0051335 g/mol
Monoisotopic Mass 412.0051335 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 551
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