TL;DR: Alendronic Acid (CAS 66376-36-1) is a chemical compound with molecular formula C4H13NO7P2 and molecular weight 249.01672 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
阿仑膦酸
(4-amino-1-hydroxy-1-phosphonobutyl)phosphonic acid
Also Known As: ALENDRONIC ACID, alendronate, Arendal, Fosamax, Acido alendronico
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C4H13NO7P2 |
| Molecular Weight | 249.01672 g/mol |
| XLogP | -6.5 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.01672 Da |
| Heavy Atoms | 14 |
| Complexity | 257.0 |
| Melting Point | 235 |
| SMILES | C(CC(O)(P(=O)(O)O)P(=O)(O)O)CN |
| InChIKey | OGSPWJRAVKPPFI-UHFFFAOYSA-N |
The XLogP value of -6.5 indicates that Alendronic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting Alendronic Acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Alendronic Acid has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Alendronic Acid is 66376-36-1.
The molecular formula of Alendronic Acid is C4H13NO7P2.
The molecular weight of Alendronic Acid is 249.01672 g/mol.
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