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181647-10-9

181647-10-9 structural image
Product Name: 4-[N-ETHYL-(4-METHOXYPHENYL)METHYLAMINO]-2-BUTYNYL-2-CYCLOHEXYL-2-HYDROXYBENZENE ACETATE
Formula: C28H35NO4
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COMPUTED DESCRIPTORS

Molecular Weight 449.6 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 10
Exact Mass 449.25660860 g/mol
Monoisotopic Mass 449.25660860 g/mol
Topological Polar Surface Area 59 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 647
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