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843629-21-0

843629-21-0 structural image
Product Name: 6-(3-ethoxyphenyl)-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Formula: C16H13N5OS
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COMPUTED DESCRIPTORS

Molecular Weight 323.4 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 323.08408123 g/mol
Monoisotopic Mass 323.08408123 g/mol
Topological Polar Surface Area 93.4 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 395
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