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478029-51-5

478029-51-5 structural image
Product Name: 17-([4-(TERT-BUTYL)BENZYL]OXY)-17-AZAPENTACYCLO[6.6.5.0(2,7).0(9,14).0(15,19)]NONADECA-2(7),3,5,9(14),10,12-HEXAENE-16,18-DIONE
Formula: C29H27NO3
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COMPUTED DESCRIPTORS

Molecular Weight 437.5 g/mol
XLogP3 5.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 437.19909372 g/mol
Monoisotopic Mass 437.19909372 g/mol
Topological Polar Surface Area 46.6 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 708
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes