TL;DR: 4-Oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid (CAS 147920-37-4) is a chemical compound with molecular formula C11H8N2O3 and molecular weight 216.0535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-oxo-1-phenylpyridazine-3-carboxylic acid
Also Known As: 4-oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid, 4-oxo-1-phenyl-1,4-dihydropyridazine-3-carboxylic acid, 4-oxo-1-phenylpyridazine-3-carboxylic acid, 6P-658S, 4-Oxo-1-phenyl-pyridazine-3-carboxylic acid
| Molecular Formula | C11H8N2O3 |
| Molecular Weight | 216.0535 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.0535 Da |
| Heavy Atoms | 16 |
| Complexity | 367.0 |
| SMILES | C1=CC=C(C=C1)N2C=CC(=O)C(=N2)C(=O)O |
| InChIKey | GNPMPJJBVVFDGP-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid. Following Lipinski's Rule of Five, 4-Oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid is 147920-37-4.
The molecular formula of 4-Oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid is C11H8N2O3.
The molecular weight of 4-Oxo-1-phenyl-1,4-dihydro-3-pyridazinecarboxylic acid is 216.0535 g/mol.
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