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1023515-06-1

1023515-06-1 structural image
Product Name: 2,10-DIAZA-9-(2-(2,2-DIMETHYL(3-OXAINDAN-4-YLOXY))-5-NITROPHENYL)-5,5-DIMETHYLTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(15),3(8),11(12),13-TETRAEN-7-ONE
Formula: C31H31N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 525.6 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 525.22637110 g/mol
Monoisotopic Mass 525.22637110 g/mol
Topological Polar Surface Area 105 Ų
Heavy Atom Count 39
Formal Charge 0
Complexity 1000
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