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493013-87-9

493013-87-9 structural image
Product Name: N-(2,5-dichlorophenyl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Formula: C16H13Cl2N5OS
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COMPUTED DESCRIPTORS

Molecular Weight 394.3 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 393.0217866 g/mol
Monoisotopic Mass 393.0217866 g/mol
Topological Polar Surface Area 98 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 460
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