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98432-30-5

98432-30-5 structural image
Product Name: N-(5-Mercapto-1,3,4-thiadiazol-2-yl)-3-methylbutanamide
Formula: C7H11N3OS2
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COMPUTED DESCRIPTORS

Molecular Weight 217.3 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 217.03435433 g/mol
Monoisotopic Mass 217.03435433 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 263
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