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861140-71-8

861140-71-8 structural image
Product Name: N-(2-tert-butylphenyl)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Formula: C21H24N4OS
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COMPUTED DESCRIPTORS

Molecular Weight 380.5 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 380.16708258 g/mol
Monoisotopic Mass 380.16708258 g/mol
Topological Polar Surface Area 85.1 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 489
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