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111253-97-5

111253-97-5 structural image
Product Name: 1,3,4-Oxadiazol-2-amine, 5-(1-(4-chloro-3-pentadecylphenoxy)ethyl)-
Formula: C25H40ClN3O2
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COMPUTED DESCRIPTORS

Molecular Weight 450.1 g/mol
XLogP3 9.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 17
Exact Mass 449.2809052 g/mol
Monoisotopic Mass 449.2809052 g/mol
Topological Polar Surface Area 74.2 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 443
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