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535957-34-7

535957-34-7 structural image
Product Name: 3,5-DICHLORO-2-[[[[3-(3-NITROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula: C17H11Cl2N3O5S
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COMPUTED DESCRIPTORS

Molecular Weight 440.3 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 438.9796470 g/mol
Monoisotopic Mass 438.9796470 g/mol
Topological Polar Surface Area 156 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 657
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes