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478039-60-0

478039-60-0 structural image
Product Name: ETHYL 2-([(2-CYANO-4,5-DIMETHOXYANILINO)CARBOTHIOYL]AMINO)ACETATE
Formula: C14H17N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 323.37 g/mol
XLogP3 2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 323.09397721 g/mol
Monoisotopic Mass 323.09397721 g/mol
Topological Polar Surface Area 125 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 437
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