![4-[(2-Thiophen-2-ylacetyl)amino]benzoate structure](/static/products/436/436088-76-5.png)
4-[(2-Thiophen-2-ylacetyl)amino]benzoate
TL;DR: 4-[(2-Thiophen-2-ylacetyl)amino]benzoate (CAS 436088-76-5) is a chemical compound with molecular formula C13H10NO3S- and molecular weight 260.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-thiophen-2-ylacetyl)amino]benzoate
Also Known As: 4-[(thien-2-ylacetyl)amino]benzoic acid, 4-[[2-(2-thienyl)acetyl]amino]benzoate, 4-[(2-thiophen-2-ylacetyl)amino]benzoate
| Molecular Formula | C13H10NO3S- |
|---|---|
| Molecular Weight | 260.04 g/mol |
| LogP | 1.2928 |
| Topological Polar Surface Area | 69.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.03815 |
| Heavy Atoms | 18 |
| Complexity | 546.1251 |
Chemical Identifiers
| CAS Number | 436088-76-5 |
|---|---|
| SMILES | C1=CSC(=C1)CC(=O)NC2=CC=C(C=C2)C(=O)[O-] |
Product Overview
4-[(2-Thiophen-2-ylacetyl)amino]benzoate (CAS 436088-76-5), with molecular formula C13H10NO3S- and molecular weight 260.04 g/mol. IUPAC: 4-[(2-thiophen-2-ylacetyl)amino]benzoate.
Chemical Property Profile of 4-[(2-Thiophen-2-ylacetyl)amino]benzoate
Property Insights of 4-[(2-Thiophen-2-ylacetyl)amino]benzoate
The XLogP value of 1.2928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2-Thiophen-2-ylacetyl)amino]benzoate. The TPSA of 69.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2-Thiophen-2-ylacetyl)amino]benzoate. Following Lipinski's Rule of Five, 4-[(2-Thiophen-2-ylacetyl)amino]benzoate has 1 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 4-[(2-Thiophen-2-ylacetyl)amino]benzoate?
The CAS number of 4-[(2-Thiophen-2-ylacetyl)amino]benzoate is 436088-76-5.
What is the molecular formula of 4-[(2-Thiophen-2-ylacetyl)amino]benzoate?
The molecular formula of 4-[(2-Thiophen-2-ylacetyl)amino]benzoate is C13H10NO3S-.
What is the molecular weight of 4-[(2-Thiophen-2-ylacetyl)amino]benzoate?
The molecular weight of 4-[(2-Thiophen-2-ylacetyl)amino]benzoate is 260.04 g/mol.
Where can I buy 4-[(2-Thiophen-2-ylacetyl)amino]benzoate?
You can request a quote for 4-[(2-Thiophen-2-ylacetyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2-Thiophen-2-ylacetyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2-Thiophen-2-ylacetyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.