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321431-75-8

321431-75-8 structural image
Product Name: N-(4-([(4-BROMOPHENYL)SULFANYL]METHYL)PHENYL)-3-(TRIFLUOROMETHYL)BENZENECARBOXAMIDE
Formula: C21H15BrF3NOS
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COMPUTED DESCRIPTORS

Molecular Weight 466.3 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 465.00098 g/mol
Monoisotopic Mass 465.00098 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 502
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