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484680-21-9

484680-21-9 structural image
Product Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Formula: C20H20N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 396.5 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 396.12561169 g/mol
Monoisotopic Mass 396.12561169 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 532
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