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587010-14-8

587010-14-8 structural image
Product Name: N-(1,1-dioxothiolan-3-yl)-2-phenoxy-N-[(4-propan-2-ylphenyl)methyl]acetamide
Formula: C22H27NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 401.5 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 401.16607952 g/mol
Monoisotopic Mass 401.16607952 g/mol
Topological Polar Surface Area 72.1 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 599
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