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351370-87-1

351370-87-1 structural image
Product Name: dimethyl 2-(1,2,2,6-tetramethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-1,3-dithiole-4,5-dicarboxylate
Formula: C20H21NO4S3
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COMPUTED DESCRIPTORS

Molecular Weight 435.6 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 435.06327167 g/mol
Monoisotopic Mass 435.06327167 g/mol
Topological Polar Surface Area 139 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 756
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