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872987-26-3

872987-26-3 structural image
Product Name: N-[[3-(4-fluoro-2-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N'-(pyridin-4-ylmethyl)oxamide
Formula: C20H23FN4O5S
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COMPUTED DESCRIPTORS

Molecular Weight 450.5 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 450.13731918 g/mol
Monoisotopic Mass 450.13731918 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 726
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