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477711-48-1

477711-48-1 structural image
Product Name: N-[2-(1,3-DIMETHYL-5-PHENOXY-1H-PYRAZOL-4-YL)ETHYL]BENZENECARBOXAMIDE
Formula: C20H21N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 335.4 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 335.16337692 g/mol
Monoisotopic Mass 335.16337692 g/mol
Topological Polar Surface Area 56.2 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 419
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