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672331-78-1

672331-78-1 structural image
Product Name: (5Z)-2-(4-bromoanilino)-5-[(4-octoxyphenyl)methylidene]-1,3-thiazol-4-one
Formula: C24H27BrN2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 487.5 g/mol
XLogP3 8.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 10
Exact Mass 486.09766 g/mol
Monoisotopic Mass 486.09766 g/mol
Topological Polar Surface Area 76 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 594
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