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577764-21-7

577764-21-7 structural image
Product Name: 2-[[4-amino-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propan-2-ylphenyl)acetamide
Formula: C19H20ClN5OS
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COMPUTED DESCRIPTORS

Molecular Weight 401.9 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 401.1077091 g/mol
Monoisotopic Mass 401.1077091 g/mol
Topological Polar Surface Area 111 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 497
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