Indium In-111 pentetate disodiumProduct ingredient for Indium In-111 pentetate
- Name
- Indium In-111 pentetate disodium
- Drug Entry
- Indium In-111 pentetate
Indium In-111 pentetate disodium is a radioactive diagnostic indicated for use in radionuclide cisternography. Decay of In-111 by electron capture allows for detection with a gamma camera for visualization of the brain and spinal column.
- Accession Number
- DBSALT002473
- Structure
Structure for Indium In-111 pentetate disodium (DBSALT002473)
- Synonyms
- Indium (In111) disodium pentetate / Pentetate indium disodium In 111 / Pentetate indium disodium In-111 / Pentetate indium disodium, In-111 / Pentetate indium disodium,in-111
- UNII
- 7UIT3ZGC8E
- CAS Number
- 60662-14-8
- Weight
- Average: 545.194
Monoisotopic: 544.98386803 - Chemical Formula
- C14H18InN3Na2O10
- InChI Key
- JKGXLBAWNSPIFF-LWQDMHIUSA-I
- InChI
- InChI=1S/C14H23N3O10.In.2Na/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;/q;+3;2*+1/p-5/i;1-4;;
- IUPAC Name
- (111In)indium(3+) ion disodium 2-[bis({2-[bis(carboxymethyl)amino]ethyl})amino]acetate
- SMILES
- [Na+].[Na+].[111In+3].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CCN(CC([O-])=O)CC([O-])=O
- External Links
- ChemSpider
- 25047638
- Predicted Properties
Property Value Source Water Solubility 6.45 mg/mL ALOGPS logP 0.69 ALOGPS logP -6.3 Chemaxon logS -2 ALOGPS pKa (Strongest Acidic) 1.95 Chemaxon pKa (Strongest Basic) 8.82 Chemaxon Physiological Charge -3 Chemaxon Hydrogen Acceptor Count 13 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 210.37 Å2 Chemaxon Rotatable Bond Count 16 Chemaxon Refractivity 140.63 m3·mol-1 Chemaxon Polarizability 34.61 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon