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339276-44-7

339276-44-7 structural image
Product Name: N'-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-N-([3-(4-METHOXYPHENYL)-2-METHYLTETRAHYDRO-5-ISOXAZOLYL]METHYL)-N'-METHYLMETHANESULFONOHYDRAZIDE
Formula: C20H24ClF3N4O4S
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COMPUTED DESCRIPTORS

Molecular Weight 508.9 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 7
Exact Mass 508.1158886 g/mol
Monoisotopic Mass 508.1158886 g/mol
Topological Polar Surface Area 83.6 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 749
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