5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid
TL;DR: 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid (CAS 381184-74-3) is a chemical compound with molecular formula C11H9F3N2O3 and molecular weight 274.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxylic acid
Also Known As: 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid, BAS 07727714, 5-((5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)methyl)furan-2-carboxylic acid, BRD-K71686567-001-01-8, 5-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxylic acid
| Molecular Formula | C11H9F3N2O3 |
|---|---|
| Molecular Weight | 274.06 g/mol |
| LogP | 2.54982 |
| Topological Polar Surface Area | 68.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.05652 |
| Heavy Atoms | 19 |
| Complexity | 612.9743 |
Chemical Identifiers
| CAS Number | 381184-74-3 |
|---|---|
| SMILES | CC1=CC(=NN1CC2=CC=C(O2)C(=O)O)C(F)(F)F |
Product Overview
5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid (CAS 381184-74-3), with molecular formula C11H9F3N2O3 and molecular weight 274.06 g/mol. IUPAC: 5-[[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]methyl]furan-2-carboxylic acid.
Chemical Property Profile of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid
Property Insights of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid
The XLogP value of 2.54982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid. The TPSA of 68.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid. Following Lipinski's Rule of Five, 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid?
The CAS number of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid is 381184-74-3.
What is the molecular formula of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid?
The molecular formula of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid is C11H9F3N2O3.
What is the molecular weight of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid?
The molecular weight of 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid is 274.06 g/mol.
Where can I buy 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid?
You can request a quote for 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(5-Methyl-3-trifluoromethyl-pyrazol-1-ylmethyl)-furan-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.