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321392-10-3

321392-10-3 structural image
Product Name: 10-(3,4-DIMETHOXYPHENETHYL)-9,11-DIOXO-3-OXA-4,10-DIAZATETRACYCLO[5.5.1.0(2,6).0(8,12)]TRIDEC-4-ENE-5-CARBOXAMIDE
Formula: C21H23N3O6
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COMPUTED DESCRIPTORS

Molecular Weight 413.4 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 413.15868546 g/mol
Monoisotopic Mass 413.15868546 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 800
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 6
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes