Ibandronate (sodium hydrate)

Ibandronate is a bisphosphonate that has been used in formulations for the treatment of osteoporosis. It binds to hydroxyapatite crystals with an affinity constant of 2.36 µM, inhibiting their growth and bone resorption.Formal Name: P,P'-[1-hydroxy-3-(methylpentylamino)propylidene]bis-phosphonic acid, monosodium salt, monohydrate. CAS Number: 138926-19-9. Molecular Formula: C9H22NO7P2 . Na [H2O]. Formula Weight: 359.2. Purity: >95%. Formulation: (Request formulation change), A crystalline solid. Solubility: PBS (pH 7.2): 0.25 mg/ml. SMILES: CN(CCCCC)CCC(P(O)([O-])=O)(O)P(O)(O)=O.[Na+].O. InChi Code: InChI=1S/C9H23NO7P2.Na.H2O/c1-3-4-5-7-10(2)8-6-9(11,18(12,13)14)19(15,16)17,,/h11H,3-8H2,1-2H3,(H2,12,13,14)(H2,15,16,17),,1H2/q,+1,/p-1. InChi Key: VBDRTGFACFYFCT-UHFFFAOYSA-M.