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332856-49-2

332856-49-2 structural image
Product Name: 5-BENZO[1,3]DIOXOL-5-YL-7-TRIFLUOROMETHYL-4,5,6,7-TETRAHYDRO-PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
Formula: C15H12F3N3O4
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COMPUTED DESCRIPTORS

Molecular Weight 355.27 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 2
Exact Mass 355.07799036 g/mol
Monoisotopic Mass 355.07799036 g/mol
Topological Polar Surface Area 85.6 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 535
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes