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72621-59-1

72621-59-1 structural image
Product Name: N-[[(2-Methyl-5-nitrophenyl)amino]thioxomethyl]acetamide
Formula: C10H11N3O3S
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COMPUTED DESCRIPTORS

Molecular Weight 253.28 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 253.05211239 g/mol
Monoisotopic Mass 253.05211239 g/mol
Topological Polar Surface Area 119 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 329
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