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896856-38-5

896856-38-5 structural image
Product Name: N-(2-tert-butylphenyl)-2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Formula: C24H24N6OS
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COMPUTED DESCRIPTORS

Molecular Weight 444.6 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 444.17323058 g/mol
Monoisotopic Mass 444.17323058 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 608
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