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487024-71-5

487024-71-5 structural image
Product Name: 2-{[3-cyano-6-(3,4-dimethoxyphenyl)pyridin-2-yl]sulfanyl}-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
Formula: C21H21N5O3S3
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COMPUTED DESCRIPTORS

Molecular Weight 487.6 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 10
Exact Mass 487.08065307 g/mol
Monoisotopic Mass 487.08065307 g/mol
Topological Polar Surface Area 189 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 651
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