TL;DR: Diodone acid (CAS 101-29-1) is a chemical compound with molecular formula C7H5I2NO3 and molecular weight 404.83588 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3,5-diiodo-4-oxo-1-pyridinyl)acetic acid
Also Known As: Pelvirinic acid, Umbradilic acid, Diodone acid, 3,5-Diiodo-4-pyridone-1-acetic Acid, Diodone
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H5I2NO3 |
| Molecular Weight | 404.83588 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.83588 Da |
| Heavy Atoms | 13 |
| Complexity | 300.0 |
| SMILES | C1=C(C(=O)C(=CN1CC(=O)O)I)I |
| InChIKey | PVBALTLWZVEAIO-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diodone acid. With a topological polar surface area (TPSA) of 57.6 Ų, Diodone acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diodone acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Diodone acid is 101-29-1.
The molecular formula of Diodone acid is C7H5I2NO3.
The molecular weight of Diodone acid is 404.83588 g/mol.
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