![4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid structure](/static/products/3390/339024-98-5.webp)
4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid
TL;DR: 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid (CAS 339024-98-5) is a chemical compound with molecular formula C14H10F3NO3 and molecular weight 297.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]benzoic acid
Also Known As: 4-{[2-oxo-5-(trifluoromethyl)-1,2-dihydropyridin-1-yl]methyl}benzoic acid, 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid, 4-[[2-oxo-5-(trifluoromethyl)pyridin-1-yl]methyl]benzoic Acid, 4-((2-Oxo-5-(trifluoromethyl)pyridin-1(2H)-yl)methyl)benzoic acid, 4-[[2-oxo-5-(trifluoromethyl)-1-pyridyl]methyl]benzoic acid
| Molecular Formula | C14H10F3NO3 |
|---|---|
| Molecular Weight | 297.06 g/mol |
| LogP | 2.6136 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.06128 |
| Heavy Atoms | 21 |
| Complexity | 717.4795 |
Chemical Identifiers
| CAS Number | 339024-98-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=C(C=CC2=O)C(F)(F)F)C(=O)O |
Product Overview
4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid (CAS 339024-98-5), with molecular formula C14H10F3NO3 and molecular weight 297.06 g/mol. IUPAC: 4-[[2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]benzoic acid.
Chemical Property Profile of 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid
Property Insights of 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid
The XLogP value of 2.6136 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid. With a topological polar surface area (TPSA) of 59.3 Ų, 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid has 1 hydrogen bond donor(s) and 2 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 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid?
The CAS number of 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid is 339024-98-5.
What is the molecular formula of 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid?
The molecular formula of 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid is C14H10F3NO3.
What is the molecular weight of 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid?
The molecular weight of 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid is 297.06 g/mol.
Where can I buy 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid?
You can request a quote for 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[2-oxo-5-(trifluoromethyl)-1(2H)-pyridinyl]methyl}benzenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.