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682775-71-9

682775-71-9 structural image
Product Name: ethyl 2-((E)-5-((E)-2-methyl-3-phenylallylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetate
Formula: C17H17NO3S2
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COMPUTED DESCRIPTORS

Molecular Weight 347.5 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 347.06498575 g/mol
Monoisotopic Mass 347.06498575 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 548
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes