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844826-72-8

844826-72-8 structural image
Product Name: (6E)-6-[(3,4-dimethoxyphenyl)methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Formula: C19H15N5O3S
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COMPUTED DESCRIPTORS

Molecular Weight 393.4 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 393.08956053 g/mol
Monoisotopic Mass 393.08956053 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 750
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