2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid
TL;DR: 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid (CAS 199461-24-0) is a chemical compound with molecular formula C13H13NO3S and molecular weight 263.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyanilino)-2-thiophen-2-ylacetic acid
Also Known As: 2-(4-methoxyanilino)-2-(2-thienyl)acetic acid, methoxyanilinothienylaceticacid, 2-((4-Methoxyphenyl)amino)-2-(thiophen-2-yl)acetic acid, 6720AD, 2-(4-methoxyanilino)-2-thiophen-2-ylacetic acid
| Molecular Formula | C13H13NO3S |
|---|---|
| Molecular Weight | 263.06 g/mol |
| LogP | 2.9945 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.0616 |
| Heavy Atoms | 18 |
| Complexity | 507.54245 |
Chemical Identifiers
| CAS Number | 199461-24-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(C2=CC=CS2)C(=O)O |
Product Overview
2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid (CAS 199461-24-0), with molecular formula C13H13NO3S and molecular weight 263.06 g/mol. IUPAC: 2-(4-methoxyanilino)-2-thiophen-2-ylacetic acid.
Chemical Property Profile of 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid
Property Insights of 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid
The XLogP value of 2.9945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid. With a topological polar surface area (TPSA) of 58.56 Ų, 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methoxyanilino)-2-(2-thienyl)acetic 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-(4-Methoxyanilino)-2-(2-thienyl)acetic acid?
The CAS number of 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid is 199461-24-0.
What is the molecular formula of 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid?
The molecular formula of 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid is C13H13NO3S.
What is the molecular weight of 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid?
The molecular weight of 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid is 263.06 g/mol.
Where can I buy 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid?
You can request a quote for 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyanilino)-2-(2-thienyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.