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86319-91-7

86319-91-7 structural image
Product Name: 1-(2-Benzothiazolyl)-1,3-butanedione 3-(phenylhydrazone)
Formula: C17H15N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 309.4 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 309.09358328 g/mol
Monoisotopic Mass 309.09358328 g/mol
Topological Polar Surface Area 82.6 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 420
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