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876889-83-7

876889-83-7 structural image
Product Name: 3-tert-butyl-6-[(3,4-dimethoxyphenyl)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Formula: C16H20N4O2S
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COMPUTED DESCRIPTORS

Molecular Weight 332.4 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 332.13069707 g/mol
Monoisotopic Mass 332.13069707 g/mol
Topological Polar Surface Area 89.8 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 406
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