2-(2-Thiophen-2-yl-acetylamino)-benzoic acid
TL;DR: 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid (CAS 330635-60-4) is a chemical compound with molecular formula C13H11NO3S and molecular weight 261.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-thiophen-2-ylacetyl)amino]benzoic acid
Also Known As: 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid, 2-[(2-thiophen-2-ylacetyl)amino]benzoic acid, 2-(2-(Thiophen-2-yl)acetamido)benzoic acid, 2-Pyrazoline,1-methyl-4-propyl, 2-[2-(thiophen-2-yl)acetamido]benzoic acid
| Molecular Formula | C13H11NO3S |
|---|---|
| Molecular Weight | 261.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.04596 |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 330635-60-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC(=O)CC2=CC=CS2 |
| InChIKey | YBFXZOGWPLCRJL-UHFFFAOYSA-N |
Product Overview
2-(2-Thiophen-2-yl-acetylamino)-benzoic acid (CAS 330635-60-4), with molecular formula C13H11NO3S and molecular weight 261.05 g/mol. IUPAC: 2-[(2-thiophen-2-ylacetyl)amino]benzoic acid.
Chemical Property Profile of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid
Property Insights of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid
The XLogP value of 3.2 indicates that 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid. Following Lipinski's Rule of Five, 2-(2-Thiophen-2-yl-acetylamino)-benzoic 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
Frequently Asked Questions
What is the CAS number of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid?
The CAS number of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid is 330635-60-4.
What is the molecular formula of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid?
The molecular formula of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid is C13H11NO3S.
What is the molecular weight of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid?
The molecular weight of 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid is 261.05 g/mol.
Where can I buy 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid?
You can request a quote for 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Thiophen-2-yl-acetylamino)-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.