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212771-00-1

212771-00-1 structural image
Product Name: ETHYL 1-(4-METHOXYBENZYL)-4-[(4-METHOXYPHENYL)SULFONYL]-4-PIPERIDINECARBOXYLATE
Formula: C23H29NO6S
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COMPUTED DESCRIPTORS

Molecular Weight 447.5 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 9
Exact Mass 447.17155882 g/mol
Monoisotopic Mass 447.17155882 g/mol
Topological Polar Surface Area 90.5 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 667
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes