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896848-21-8

896848-21-8 structural image
Product Name: 1,3-diphenyl-5-[(2-phenylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Formula: C25H21N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 427.5 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 427.13544809 g/mol
Monoisotopic Mass 427.13544809 g/mol
Topological Polar Surface Area 88.2 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 702
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