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56796-16-8

56796-16-8 structural image
Product Name: 7-[[[(CyanoMethyl)thio]acetyl]aMino]-7-Methoxy Cephalosporanic Acid
Formula: C15H17N3O7S2
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COMPUTED DESCRIPTORS

Molecular Weight 415.4 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 9
Exact Mass 415.05079224 g/mol
Monoisotopic Mass 415.05079224 g/mol
Topological Polar Surface Area 197 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 760
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes