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951971-38-3

951971-38-3 structural image
Product Name: 4-[(5E)-5-[(5-fluoro-2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid
Formula: C18H15FN2O5S2
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COMPUTED DESCRIPTORS

Molecular Weight 422.5 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 7
Exact Mass 422.04064209 g/mol
Monoisotopic Mass 422.04064209 g/mol
Topological Polar Surface Area 157 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 795
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes