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885722-38-3

885722-38-3 structural image
Product Name: 1,4-DIBENZYL-7-PHENYL-6-THIOXO-1,4,7-TRIAZA-SPIRO[4.4]NON-8-ENE-9-CARBOXYLIC ACID ETHYL ESTER
Formula: C29H29N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 483.6 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 483.19804835 g/mol
Monoisotopic Mass 483.19804835 g/mol
Topological Polar Surface Area 68.1 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 753
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