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899378-43-9

899378-43-9 structural image
Product Name: 2-[1-(7-methyl-2,3,4,7,9,10-hexahydro-[1,4]dioxepino[2,3-g]isoquinolin-8-yl)-4-methylsulfanyl-1-oxobutan-2-yl]isoindole-1,3-dione
Formula: C26H28N2O5S
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COMPUTED DESCRIPTORS

Molecular Weight 480.6 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 480.17189317 g/mol
Monoisotopic Mass 480.17189317 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 769
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes