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306756-08-1

306756-08-1 structural image
Product Name: N-[(E)-anthracen-9-ylmethylideneamino]-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Formula: C31H23N5OS
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COMPUTED DESCRIPTORS

Molecular Weight 513.6 g/mol
XLogP3 7.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 513.16233155 g/mol
Monoisotopic Mass 513.16233155 g/mol
Topological Polar Surface Area 97.5 Ų
Heavy Atom Count 38
Formal Charge 0
Complexity 775
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes