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847410-50-8

847410-50-8 structural image
Product Name: N-(4-methoxyphenyl)-2-(4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydrobenzo[b][1,4]thiazepin-5(2H)-yl)acetamide
Formula: C27H28N2O6S
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COMPUTED DESCRIPTORS

Molecular Weight 508.6 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 508.16680779 g/mol
Monoisotopic Mass 508.16680779 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 719
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes