TL;DR: 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid (CAS 164295-94-7) is a chemical compound with molecular formula C14H10N2O2 and molecular weight 238.07423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-naphthalen-2-yl-1H-pyrazole-5-carboxylic acid
Also Known As: 5-Naphthalen-2-yl-1H-pyrazole-3-carboxylic acid, 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid, N-Carbobenzyloxy-2-methylalanine, 3-(naphthalen-2-yl)-1H-pyrazole-5-carboxylic acid, 3-naphthalen-2-yl-1H-pyrazole-5-carboxylic acid
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H10N2O2 |
| Molecular Weight | 238.07423 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.07423 Da |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
| SMILES | C1=CC=C2C=C(C=CC2=C1)C3=NNC(=C3)C(=O)O |
| InChIKey | JQMUXXNJOLCBJJ-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid is 164295-94-7.
The molecular formula of 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid is C14H10N2O2.
The molecular weight of 5-(naphthalen-2-yl)-1H-pyrazole-3-carboxylic acid is 238.07423 g/mol.
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