TL;DR: ALENDRONATE SODIUM (CAS 121268-17-5) is a chemical compound with molecular formula C4H13NNaO7P2 and molecular weight 272.0065 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Also Known As: ALENDRONATE SODIUM, Osteovan, Binosto, Fosamac, Fosamax
| Molecular Formula | C4H13NNaO7P2 |
| Molecular Weight | 272.0065 g/mol |
| XLogP | -1.654 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.0065 Da |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
| SMILES | C(CC(O)(P(=O)(O)O)P(=O)(O)O)CN.[Na] |
| InChIKey | NLILQNGSPQHASV-UHFFFAOYSA-N |
The XLogP value of -1.654 indicates that ALENDRONATE SODIUM is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting ALENDRONATE SODIUM may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ALENDRONATE SODIUM has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ALENDRONATE SODIUM is 121268-17-5.
The molecular formula of ALENDRONATE SODIUM is C4H13NNaO7P2.
The molecular weight of ALENDRONATE SODIUM is 272.0065 g/mol.
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