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175202-84-3

175202-84-3 structural image
Product Name: 5-[(4-BROMO-3,5-DIMETHYL-1H-PYRAZOL-1-YL)METHYL]-1,3,4-OXADIAZOLE-2-THIOL
Formula: C8H9BrN4OS
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COMPUTED DESCRIPTORS

Molecular Weight 289.15 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 287.96804 g/mol
Monoisotopic Mass 287.96804 g/mol
Topological Polar Surface Area 83.5 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 311
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