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339031-27-5

339031-27-5 structural image
Product Name: N-(4-[(4-BROMOPHENYL)SULFANYL]PHENYL)-3-(TRIFLUOROMETHYL)BENZENECARBOXAMIDE
Formula: C20H13BrF3NOS
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COMPUTED DESCRIPTORS

Molecular Weight 452.3 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 450.98533 g/mol
Monoisotopic Mass 450.98533 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 488
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