4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid
TL;DR: 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid (CAS 676318-17-5) is a chemical compound with molecular formula C8H6F3NO3S and molecular weight 253.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-[(2,2,2-trifluoroacetyl)amino]thiophene-2-carboxylic acid
Also Known As: 4-methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid, 4-methyl-3-[(2,2,2-trifluoroacetyl)amino]thiophene-2-carboxylic Acid
| Molecular Formula | C8H6F3NO3S |
|---|---|
| Molecular Weight | 253.00 g/mol |
| LogP | 2.25552 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.00204 |
| Heavy Atoms | 16 |
| Complexity | 438.2272 |
Chemical Identifiers
| CAS Number | 676318-17-5 |
|---|---|
| SMILES | CC1=CSC(=C1NC(=O)C(F)(F)F)C(=O)O |
Product Overview
4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid (CAS 676318-17-5), with molecular formula C8H6F3NO3S and molecular weight 253.00 g/mol. IUPAC: 4-methyl-3-[(2,2,2-trifluoroacetyl)amino]thiophene-2-carboxylic acid.
Chemical Property Profile of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid
Property Insights of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid
The XLogP value of 2.25552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 4-Methyl-3-(trifluoroacetamido)thiophene-2-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.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid?
The CAS number of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid is 676318-17-5.
What is the molecular formula of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid?
The molecular formula of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid is C8H6F3NO3S.
What is the molecular weight of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid?
The molecular weight of 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid is 253.00 g/mol.
Where can I buy 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid?
You can request a quote for 4-Methyl-3-(trifluoroacetamido)thiophene-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 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-3-(trifluoroacetamido)thiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.