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876885-11-9

876885-11-9 structural image
Product Name: 6-(4-methoxyphenyl)-3-propan-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Formula: C13H14N4OS
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COMPUTED DESCRIPTORS

Molecular Weight 274.34 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 274.08883226 g/mol
Monoisotopic Mass 274.08883226 g/mol
Topological Polar Surface Area 80.6 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 309
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