TL;DR: (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid (CAS 151297-05-1) is a chemical compound with molecular formula C5H10N3O4P and molecular weight 207.0409 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-hydroxy-3-(1H-1,2,4-triazol-5-yl)propyl]phosphonic acid
Also Known As: (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid, [2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl]phosphonic acid, Phosphonic acid, (2-hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)-, [2-hydroxy-3-(1H-1,2,4-triazol-5-yl)propyl]phosphonic acid
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C5H10N3O4P |
| Molecular Weight | 207.0409 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.0409 Da |
| Heavy Atoms | 13 |
| Complexity | 208.0 |
| SMILES | C1=NNC(=N1)CC(CP(=O)(O)O)O |
| InChIKey | VLMXPQOQPPENLQ-UHFFFAOYSA-N |
The XLogP value of -2.2 indicates that (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid. Following Lipinski's Rule of Five, (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid is 151297-05-1.
The molecular formula of (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid is C5H10N3O4P.
The molecular weight of (2-Hydroxy-3-(1H-1,2,4-triazol-3-yl)propyl)phosphonic acid is 207.0409 g/mol.
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