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104690-49-5

104690-49-5 structural image
Product Name: 6-BROMO-5-METHYL-2-METHYLSULFANYL-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-OL
Formula: C7H7BrN4OS
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COMPUTED DESCRIPTORS

Molecular Weight 275.13 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 273.95239 g/mol
Monoisotopic Mass 273.95239 g/mol
Topological Polar Surface Area 82.4 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 401
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