![2-[(2-Thienylmethyl)amino]benzoic acid structure](/static/products/182/18210-20-3.png)
2-[(2-Thienylmethyl)amino]benzoic acid
TL;DR: 2-[(2-Thienylmethyl)amino]benzoic acid (CAS 18210-20-3) is a chemical compound with molecular formula C12H11NO2S and molecular weight 233.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(thiophen-2-ylmethylamino)benzoic acid
Also Known As: 2-[(2-thienylmethyl)amino]benzoic acid, 2-(thiophen-2-ylmethylamino)benzoic acid, o-carboxyphenyl-(2-thenyl)amine, 2-((Thiophen-2-ylmethyl)amino)benzoic acid, BAS 12419833
| Molecular Formula | C12H11NO2S |
|---|---|
| Molecular Weight | 233.05 g/mol |
| LogP | 3.0584 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.05106 |
| Heavy Atoms | 16 |
| Complexity | 479.5238 |
Chemical Identifiers
| CAS Number | 18210-20-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NCC2=CC=CS2 |
Product Overview
2-[(2-Thienylmethyl)amino]benzoic acid (CAS 18210-20-3), with molecular formula C12H11NO2S and molecular weight 233.05 g/mol. IUPAC: 2-(thiophen-2-ylmethylamino)benzoic acid.
Chemical Property Profile of 2-[(2-Thienylmethyl)amino]benzoic acid
Property Insights of 2-[(2-Thienylmethyl)amino]benzoic acid
The XLogP value of 3.0584 indicates that 2-[(2-Thienylmethyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, 2-[(2-Thienylmethyl)amino]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2-Thienylmethyl)amino]benzoic 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 2-[(2-Thienylmethyl)amino]benzoic acid?
The CAS number of 2-[(2-Thienylmethyl)amino]benzoic acid is 18210-20-3.
What is the molecular formula of 2-[(2-Thienylmethyl)amino]benzoic acid?
The molecular formula of 2-[(2-Thienylmethyl)amino]benzoic acid is C12H11NO2S.
What is the molecular weight of 2-[(2-Thienylmethyl)amino]benzoic acid?
The molecular weight of 2-[(2-Thienylmethyl)amino]benzoic acid is 233.05 g/mol.
Where can I buy 2-[(2-Thienylmethyl)amino]benzoic acid?
You can request a quote for 2-[(2-Thienylmethyl)amino]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-Thienylmethyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Thienylmethyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.