2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid
TL;DR: 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid (CAS 338793-83-2) is a chemical compound with molecular formula C10H9F2NO4S and molecular weight 277.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2,4-difluoroanilino)-2-oxoethyl]sulfinylacetic acid
Also Known As: 2-{[2-(2,4-difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid, 2-{[(2,4-difluorophenyl)carbamoyl]methanesulfinyl}acetic acid, 2-[2-(2,4-difluoroanilino)-2-oxoethyl]sulfinylacetic acid, 2-((2-(2,4-Difluoroanilino)-2-oxoethyl)sulfinyl)acetic acid, [2-(2,4-Difluoroanilino)-2-oxoethanesulfinyl]acetic acid
| Molecular Formula | C10H9F2NO4S |
|---|---|
| Molecular Weight | 277.02 g/mol |
| LogP | 0.7366 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.02203 |
| Heavy Atoms | 18 |
| Complexity | 506.6511 |
Chemical Identifiers
| CAS Number | 338793-83-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)F)NC(=O)CS(=O)CC(=O)O |
Product Overview
2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid (CAS 338793-83-2), with molecular formula C10H9F2NO4S and molecular weight 277.02 g/mol. IUPAC: 2-[2-(2,4-difluoroanilino)-2-oxoethyl]sulfinylacetic acid.
Chemical Property Profile of 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid
Property Insights of 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid
The XLogP value of 0.7366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid. Following Lipinski's Rule of Five, 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic 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-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid?
The CAS number of 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid is 338793-83-2.
What is the molecular formula of 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid?
The molecular formula of 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid is C10H9F2NO4S.
What is the molecular weight of 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid?
The molecular weight of 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid is 277.02 g/mol.
Where can I buy 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid?
You can request a quote for 2-{[2-(2,4-Difluoroanilino)-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-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-(2,4-Difluoroanilino)-2-oxoethyl]sulfinyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.