![2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid structure](/static/products/3389/338953-84-7.webp)
2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid
TL;DR: 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid (CAS 338953-84-7) is a chemical compound with molecular formula C11H13NO4S and molecular weight 255.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-methylanilino)-2-oxoethyl]sulfinylacetic acid
Also Known As: ASN 03451541, 5H-351S, (p-Tolylcarbamoyl-methanesulfinyl)-acetic acid, 2-[2-(4-methylanilino)-2-oxoethyl]sulfinylacetic acid, 2-{[(4-methylphenyl)carbamoyl]methanesulfinyl}acetic acid
| Molecular Formula | C11H13NO4S |
|---|---|
| Molecular Weight | 255.06 g/mol |
| LogP | 0.76682 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.05653 |
| Heavy Atoms | 17 |
| Complexity | 441.28958 |
Chemical Identifiers
| CAS Number | 338953-84-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CS(=O)CC(=O)O |
Product Overview
2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid (CAS 338953-84-7), with molecular formula C11H13NO4S and molecular weight 255.06 g/mol. IUPAC: 2-[2-(4-methylanilino)-2-oxoethyl]sulfinylacetic acid.
Chemical Property Profile of 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid
Property Insights of 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid
The XLogP value of 0.76682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid. Following Lipinski's Rule of Five, 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic 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-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid?
The CAS number of 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid is 338953-84-7.
What is the molecular formula of 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid?
The molecular formula of 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid is C11H13NO4S.
What is the molecular weight of 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid?
The molecular weight of 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid is 255.06 g/mol.
Where can I buy 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid?
You can request a quote for 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic 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-Methylanilino)-2-oxoethyl]sulfinylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(4-Methylanilino)-2-oxoethyl]sulfinylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.