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1352814-12-0

1352814-12-0 structural image
Product Name: 4,7,10,13,16,19-Hexaoxa-22-azaheptacosanoic acid, 27-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-23-oxo-, 2,3,4,5,6-pentafluorophenyl ester
Formula: C31H44F5N3O10S
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COMPUTED DESCRIPTORS

Molecular Weight 745.8 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 28
Exact Mass 745.26675659 g/mol
Monoisotopic Mass 745.26675659 g/mol
Topological Polar Surface Area 177 Ų
Heavy Atom Count 50
Formal Charge 0
Complexity 985
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes