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306980-51-8

306980-51-8 structural image
Product Name: N-(3-THIOXO-3H-1,2,4-DITHIAZOL-5-YL)-3-(TRIFLUOROMETHYL)BENZENECARBOXAMIDE
Formula: C10H5F3N2OS3
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COMPUTED DESCRIPTORS

Molecular Weight 322.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 2
Exact Mass 321.95161079 g/mol
Monoisotopic Mass 321.95161079 g/mol
Topological Polar Surface Area 124 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 425
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