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532979-46-7

532979-46-7 structural image
Product Name: 4-[[[[(3,5-DIMETHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula: C18H18N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 358.4 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 358.09872823 g/mol
Monoisotopic Mass 358.09872823 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 482
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