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462097-63-8

462097-63-8 structural image
Product Name: 3-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID
Formula: C18H17ClN2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 392.9 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 392.0597559 g/mol
Monoisotopic Mass 392.0597559 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 533
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