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879472-86-3

879472-86-3 structural image
Product Name: 2-[[4-amino-5-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]-N-(4-butylphenyl)acetamide
Formula: C24H27N7O2S
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COMPUTED DESCRIPTORS

Molecular Weight 477.6 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 10
Exact Mass 477.19469430 g/mol
Monoisotopic Mass 477.19469430 g/mol
Topological Polar Surface Area 149 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 628
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