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394239-02-2

394239-02-2 structural image
Product Name: N-(5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl)-2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)butanamide
Formula: C17H20N6O3S2
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COMPUTED DESCRIPTORS

Molecular Weight 420.5 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 8
Exact Mass 420.10383087 g/mol
Monoisotopic Mass 420.10383087 g/mol
Topological Polar Surface Area 158 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 519
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes