Tiludronate DisodiumProduct ingredient for Tiludronic acid
- Name
- Tiludronate Disodium
- Drug Entry
- Tiludronic acid
Tiludronate, or (4-chlorophenyl)thio-methylene-1,1-bisphosphonate, is a first generation bisphosphonate similar to etidronic acid and clodronic acid.1,7 These drugs were developed to mimic the action of pyrophosphate, a regulator of calcification and decalcification.1 Tiludronic acid was first described in the literature in 1988 as a potential treatment for Paget's disease of bone.5
Tiludronic acid was granted FDA approval on 7 March 1997.8
- Accession Number
- DBSALT000411
- Structure
Structure for Tiludronate Disodium (DBSALT000411)
- Synonyms
- Tiludronate disodium anhydrous / Tiludronate sodium / Tiludronic acid disodium salt
- External IDs
- SR 41319B / SR-41319B
- UNII
- BH6M93CIA0
- CAS Number
- 149845-07-8
- Weight
- Average: 362.56
Monoisotopic: 361.8922494 - Chemical Formula
- C7H7ClNa2O6P2S
- InChI Key
- SKUHWSDHMJMHIW-UHFFFAOYSA-L
- InChI
- InChI=1S/C7H9ClO6P2S.2Na/c8-5-1-3-6(4-2-5)17-7(15(9,10)11)16(12,13)14;;/h1-4,7H,(H2,9,10,11)(H2,12,13,14);;/q;2*+1/p-2
- IUPAC Name
- disodium {[(4-chlorophenyl)sulfanyl](phosphono)methyl}phosphonate
- SMILES
- [Na+].[Na+].OP(O)(=O)C(SC1=CC=C(Cl)C=C1)P([O-])([O-])=O
- External Links
- KEGG Compound
- C08141
- PubChem Compound
- 60937
- ChemSpider
- 54904
- ChEMBL
- CHEMBL1200448
- Predicted Properties
Property Value Source Water Solubility 9.01 mg/mL ALOGPS logP 1.25 ALOGPS logP 1.32 Chemaxon logS -1.6 ALOGPS pKa (Strongest Acidic) 1.03 Chemaxon Physiological Charge -2 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 120.72 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 62.86 m3·mol-1 Chemaxon Polarizability 24.38 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon