5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid
TL;DR: 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid (CAS 1005705-54-3) is a chemical compound with molecular formula C12H10ClN3O3 and molecular weight 279.04108 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(4-chlorophenyl)carbamoyl]-1-methylpyrazole-3-carboxylic acid
Also Known As: 5-[(4-chlorophenyl)carbamoyl]-1-methyl-pyrazole-3-carboxylic Acid, 5-[(4-chlorophenyl)carbamoyl]-1-methylpyrazole-3-carboxylic acid, 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid, 5-[(4-chlorophenyl)carbamoyl]-1-methyl-1H-pyrazole-3-carboxylic acid, 5-[(4-CHLOROANILINO)CARBONYL]-1-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
Technical Specifications
| Molecular Formula | C12H10ClN3O3 |
| Molecular Weight | 279.04108 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 84.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.04108 Da |
| Heavy Atoms | 19 |
| Complexity | 358.0 |
| SMILES | CN1C(=CC(=N1)C(=O)O)C(=O)NC2=CC=C(C=C2)Cl |
| InChIKey | IWOBZUKOWWIXNA-UHFFFAOYSA-N |
Chemical Property Profile of 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid
Property Insights of 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid has 2 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 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid?
The CAS number of 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid is 1005705-54-3.
What is the molecular formula of 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid?
The molecular formula of 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid is C12H10ClN3O3.
What is the molecular weight of 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid?
The molecular weight of 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid is 279.04108 g/mol.
Where can I buy 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid?
You can request a quote for 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-((4-chlorophenyl)carbamoyl)-1-methyl-1H-pyrazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.