![2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid structure](/static/products/3389/338953-91-6.webp)
2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid
TL;DR: 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid (CAS 338953-91-6) is a chemical compound with molecular formula C11H13NO5S and molecular weight 271.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-methoxyanilino)-2-oxoethyl]sulfinylacetic acid
Also Known As: 2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid, ASN 03451545, 2-{[(4-methoxyphenyl)carbamoyl]methanesulfinyl}acetic acid, 5H-360S, 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfinylacetic acid
| Molecular Formula | C11H13NO5S |
|---|---|
| Molecular Weight | 271.05 g/mol |
| LogP | 0.467 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.05145 |
| Heavy Atoms | 18 |
| Complexity | 457.00632 |
Chemical Identifiers
| CAS Number | 338953-91-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)O |
Product Overview
2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid (CAS 338953-91-6), with molecular formula C11H13NO5S and molecular weight 271.05 g/mol. IUPAC: 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfinylacetic acid.
Chemical Property Profile of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid
Property Insights of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid
The XLogP value of 0.467 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid. Following Lipinski's Rule of Five, 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}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-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid?
The CAS number of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid is 338953-91-6.
What is the molecular formula of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid?
The molecular formula of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid is C11H13NO5S.
What is the molecular weight of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid?
The molecular weight of 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid is 271.05 g/mol.
Where can I buy 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid?
You can request a quote for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}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]sulfinyl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-(4-Methoxyanilino)-2-oxoethyl]sulfinyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.