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866132-42-5

866132-42-5 structural image
Product Name: 3-(benzenesulfonyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
Formula: C19H11F4N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 421.4 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 421.05081042 g/mol
Monoisotopic Mass 421.05081042 g/mol
Topological Polar Surface Area 72.7 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 670
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