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85414-26-2

85414-26-2 structural image
Product Name: OA 6129E
Formula: C21H35N3O8S
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COMPUTED DESCRIPTORS

Molecular Weight 489.6 g/mol
XLogP3 -1.1
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 12
Exact Mass 489.21448626 g/mol
Monoisotopic Mass 489.21448626 g/mol
Topological Polar Surface Area 202 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 775
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes