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339105-03-2

339105-03-2 structural image
Product Name: 2-CHLORO-4-(METHYLSULFONYL)-N-(4-([3-(TRIFLUOROMETHYL)PHENYL]SULFONYL)PHENYL)BENZENECARBOXAMIDE
Formula: C21H15ClF3NO5S2
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COMPUTED DESCRIPTORS

Molecular Weight 517.9 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 517.0032271 g/mol
Monoisotopic Mass 517.0032271 g/mol
Topological Polar Surface Area 114 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 906
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