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135911-02-3

135911-02-3 structural image
Product Name: (3AR,7AR)-OCTAHYDRO-2-[1-IMINO-2-(2-METHOXYPHENYL)ETHYL]-7,7-DIPHENYL-4H-ISOINDOL-4-ONE
Formula: C29H30N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 438.6 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 438.230728204 g/mol
Monoisotopic Mass 438.230728204 g/mol
Topological Polar Surface Area 53.4 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 676
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes