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64005-90-9

64005-90-9 structural image
Product Name: DIETHYL-1,3,6,8-TETRAHYDRO-1,3,6,8-TETRAOXOBENZO[IMN][3,8]PHENANTHROLINE-2,7-DIACETATE
Formula: C22H18N2O8
Synonyms: PiB, Diethyl-1,3,6,8-tetrahydro-1,3,6,8-tetraoxobenzo[lmn][3,8]phenanthroline-2,7-diacetate;PPIase-Parvulin Inhibitor - CAS 64005-90-9 - Calbiochem
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COMPUTED DESCRIPTORS

Molecular Weight 438.4 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 8
Exact Mass 438.10631554 g/mol
Monoisotopic Mass 438.10631554 g/mol
Topological Polar Surface Area 127 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 752
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes