![2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid structure](/static/products/3389/338953-92-7.webp)
2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid
TL;DR: 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid (CAS 338953-92-7) is a chemical compound with molecular formula C11H13NO6S and molecular weight 287.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-methoxyanilino)-2-oxoethyl]sulfonylacetic acid
Also Known As: 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid, methoxyanilinooxoethylsulfonylaceticacid, 0770AE, 5H-361S, 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfonylacetic acid
| Molecular Formula | C11H13NO6S |
|---|---|
| Molecular Weight | 287.05 g/mol |
| LogP | 0.1331 |
| Topological Polar Surface Area | 109.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.04636 |
| Heavy Atoms | 19 |
| Complexity | 563.35315 |
Chemical Identifiers
| CAS Number | 338953-92-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CS(=O)(=O)CC(=O)O |
Product Overview
2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid (CAS 338953-92-7), with molecular formula C11H13NO6S and molecular weight 287.05 g/mol. IUPAC: 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfonylacetic acid.
Chemical Property Profile of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid
Property Insights of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid
The XLogP value of 0.1331 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid. The TPSA of 109.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid. Following Lipinski's Rule of Five, 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid has 2 hydrogen bond donor(s) and 5 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-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid?
The CAS number of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid is 338953-92-7.
What is the molecular formula of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid?
The molecular formula of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid is C11H13NO6S.
What is the molecular weight of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid?
The molecular weight of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid is 287.05 g/mol.
Where can I buy 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid?
You can request a quote for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}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-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]-sulfonyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.