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841209-48-1

841209-48-1 structural image
Product Name: (5E)-1-(2-methoxyphenyl)-5-[(2-phenyl-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Formula: C26H19N3O3S
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COMPUTED DESCRIPTORS

Molecular Weight 453.5 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 453.11471265 g/mol
Monoisotopic Mass 453.11471265 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 889
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