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882749-57-7

882749-57-7 structural image
Product Name: Acetamide, 2-[[4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethyl)phenyl]-
Formula: C19H17F3N4OS
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COMPUTED DESCRIPTORS

Molecular Weight 406.4 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 406.10751684 g/mol
Monoisotopic Mass 406.10751684 g/mol
Topological Polar Surface Area 85.1 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 528
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