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862117-51-9

862117-51-9 structural image
Product Name: N-(3-chloro-2-methylphenyl)-2-[[5-(3-methylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Formula: C25H23ClN4OS
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COMPUTED DESCRIPTORS

Molecular Weight 463.0 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 462.1281102 g/mol
Monoisotopic Mass 462.1281102 g/mol
Topological Polar Surface Area 85.1 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 617
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