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332947-80-5

332947-80-5 structural image
Product Name: 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Formula: C24H21ClN4OS
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COMPUTED DESCRIPTORS

Molecular Weight 449.0 g/mol
XLogP3 5.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 448.1124602 g/mol
Monoisotopic Mass 448.1124602 g/mol
Topological Polar Surface Area 85.1 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 580
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