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587001-93-2

587001-93-2 structural image
Product Name: N-(1,1-dioxothiolan-3-yl)-4-heptoxy-N-[(4-propan-2-ylphenyl)methyl]benzamide
Formula: C28H39NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 485.7 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 12
Exact Mass 485.25997990 g/mol
Monoisotopic Mass 485.25997990 g/mol
Topological Polar Surface Area 72.1 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 700
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