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896850-02-5

896850-02-5 structural image
Product Name: N-(5-chloro-2-methylphenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Formula: C26H25ClN4O2S
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COMPUTED DESCRIPTORS

Molecular Weight 493.0 g/mol
XLogP3 6.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 492.1386749 g/mol
Monoisotopic Mass 492.1386749 g/mol
Topological Polar Surface Area 94.3 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 642
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