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577963-69-0

577963-69-0 structural image
Product Name: N-(3-bromophenyl)-2-[[4-(furan-2-ylmethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Formula: C19H15BrN6O2S
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COMPUTED DESCRIPTORS

Molecular Weight 471.3 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 470.01606 g/mol
Monoisotopic Mass 470.01606 g/mol
Topological Polar Surface Area 124 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 547
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