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896596-38-6

896596-38-6 structural image
Product Name: N-(3,5-dimethoxyphenyl)-2-[(4-phenyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Formula: C23H21N5O3S
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COMPUTED DESCRIPTORS

Molecular Weight 447.5 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 447.13651072 g/mol
Monoisotopic Mass 447.13651072 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 582
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