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840471-84-3

840471-84-3 structural image
Product Name: (2Z)-6-[(4-methylphenyl)methyl]-2-[(3,4,5-trimethoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
Formula: C23H21N3O5S
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COMPUTED DESCRIPTORS

Molecular Weight 451.5 g/mol
XLogP3 4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 451.12019195 g/mol
Monoisotopic Mass 451.12019195 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 820
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