Sodium ioxitalamateProduct ingredient for Ioxitalamic acid
- Name
- Sodium ioxitalamate
- Drug Entry
- Ioxitalamic acid
Ioxitalamate is an ionic iodinated contrast medium.1 It is a first-generation contrast media formed by an ionic monomer with a high osmolarity of 1500-1800 mOsm/kg.2 Ioxitalamic acid in the salt forms of sodium and meglumine was developed by Liebel-Flarshem Canada Inc and approved by Health Canada in 1995. Until the last review in 2015, this drug is still available in the market.7
- Accession Number
- DBSALT002568
- Structure
Structure for Sodium ioxitalamate (DBSALT002568)
- Synonyms
- Ioxitalamate sodium
- UNII
- 8P8Y8ZXJ8Y
- CAS Number
- 33954-26-6
- Weight
- Average: 665.924
Monoisotopic: 665.76215 - Chemical Formula
- C12H10I3N2NaO5
- InChI Key
- PZTAFRMXSAAHMQ-UHFFFAOYSA-M
- InChI
- InChI=1S/C12H11I3N2O5.Na/c1-4(19)17-10-8(14)5(11(20)16-2-3-18)7(13)6(9(10)15)12(21)22;/h18H,2-3H2,1H3,(H,16,20)(H,17,19)(H,21,22);/q;+1/p-1
- IUPAC Name
- sodium 3-acetamido-5-[(2-hydroxyethyl)carbamoyl]-2,4,6-triiodobenzoate
- SMILES
- [Na+].CC(=O)NC1=C(I)C(C([O-])=O)=C(I)C(C(=O)NCCO)=C1I
- External Links
- ChemSpider
- 33660
- Predicted Properties
Property Value Source Water Solubility 0.157 mg/mL ALOGPS logP 0.23 ALOGPS logP 2.04 Chemaxon logS -3.6 ALOGPS pKa (Strongest Acidic) 2.13 Chemaxon pKa (Strongest Basic) -1.8 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 118.56 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 119.37 m3·mol-1 Chemaxon Polarizability 41.17 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon