Products for Research Use Only

Benziodarone

CAT: 0013-GTR19195430-05Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19195430-05Size:500 mg
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Description
Benziodarone is a purine analog that selectively inhibits transthyretin amyloidogenesis. It serves as a research tool for investigating related amyloidosis and has been applied in studies of hyperuricemia and gout, including in vitro and animal model experiments.
CAS Number
68-90-6
Product Name Alternative
Carofam, Dila-Vasal, Dilacoron, Benziodarone, Corofam, Coronal-crinos
Field of Research
Pharmacology & Drug Discovery
Purity
99.85% (May vary between batches)
Smiles
O=C (C1=CC (I) =C (O) C (I) =C1) C=2C=3C=CC=CC3OC2CC
Molecular Formula
C17H12I2O3
Molecular Weight
518.08
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Benziodarone

Benziodarone is an aromatic ketone.

CAS Number68-90-6
PubChem CID6237
IUPAC Name(2-ethyl-1-benzofuran-3-yl)-(4-hydroxy-3,5-diiodophenyl)methanone
Molecular FormulaC17H12I2O3
Molecular Weight518.08
XLogP5.6
Topological Polar Surface Area50.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity405
SMILES
CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I
InChI
InChI=1S/C17H12I2O3/c1-2-13-15(10-5-3-4-6-14(10)22-13)16(20)9-7-11(18)17(21)12(19)8-9/h3-8,21H,2H2,1H3
InChIKey
CZCHIEJNWPNBDE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benziodarone
CAS: 68-90-6
CID: 6237
Formula: C17H12I2O3
MW: 518.08
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight518.08
XLogP35.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass517.88759
Monoisotopic Mass517.88759
Topological Polar Surface Area50.4 Ų
Heavy Atom Count22
Formal Charge0
Complexity405
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes