1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
TL;DR: 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid (CAS 1001779-87-8) is a chemical compound with molecular formula C13H14N2O3 and molecular weight 246.10045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methoxyphenyl)-3,5-dimethylpyrazole-4-carboxylic acid
Also Known As: 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid, BB_SC-8004, 1-(4-methoxyphenyl)-3,5-dimethylpyrazole-4-carboxylic acid, 7127AC, methoxyphenyldimethylpyrazolecarboxylicacid
Technical Specifications
| Molecular Formula | C13H14N2O3 |
| Molecular Weight | 246.10045 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.10045 Da |
| Heavy Atoms | 18 |
| Complexity | 303.0 |
| SMILES | CC1=C(C(=NN1C2=CC=C(C=C2)OC)C)C(=O)O |
| InChIKey | FCLXEGXXPRUTQZ-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
Property Insights of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid. Following Lipinski's Rule of Five, 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-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.
Frequently Asked Questions
What is the CAS number of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid?
The CAS number of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid is 1001779-87-8.
What is the molecular formula of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid?
The molecular formula of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid is C13H14N2O3.
What is the molecular weight of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid?
The molecular weight of 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid is 246.10045 g/mol.
Where can I buy 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid?
You can request a quote for 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.