TL;DR: 6-Methyl-1-oxido-pyrazin-1-ium-2-carboxylic acid (CAS 51037-30-0) is a chemical compound with molecular formula C6H6N2O3 and molecular weight 154.03784 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-1-oxidopyrazin-1-ium-2-carboxylic acid
Also Known As: ACIPIMOX, 5-Carboxy-2-methylpyrazine 1-oxide, 6-methyl-1-oxido-pyrazin-1-ium-2-carboxylic acid, 6-methyl-1-oxidopyrazin-1-ium-2-carboxylic acid
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H6N2O3 |
| Molecular Weight | 154.03784 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 75.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.03784 Da |
| Heavy Atoms | 11 |
| Complexity | 162.0 |
| SMILES | CC1=CN=CC(=[N+]1[O-])C(=O)O |
| InChIKey | DNRXJHATQULEHC-UHFFFAOYSA-N |
The XLogP value of -0.4 indicates that 6-Methyl-1-oxido-pyrazin-1-ium-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Methyl-1-oxido-pyrazin-1-ium-2-carboxylic acid. Following Lipinski's Rule of Five, 6-Methyl-1-oxido-pyrazin-1-ium-2-carboxylic 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 6-Methyl-1-oxido-pyrazin-1-ium-2-carboxylic acid is 51037-30-0.
The molecular formula of 6-Methyl-1-oxido-pyrazin-1-ium-2-carboxylic acid is C6H6N2O3.
The molecular weight of 6-Methyl-1-oxido-pyrazin-1-ium-2-carboxylic acid is 154.03784 g/mol.
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