![[(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid structure](/static/products/884/884497-65-8.png)
[(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid
TL;DR: [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid (CAS 884497-65-8) is a chemical compound with molecular formula C13H11NO4S and molecular weight 277.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-formyl-6-methoxyquinolin-2-yl)sulfanylacetic acid
Also Known As: CHEMBRDG-BB 6966505, [(3-formyl-6-methoxyquinolin-2-yl)thio]acetic acid, 1,2,4-triazol-1-ylbutanone, 2-((3-Formyl-6-methoxyquinolin-2-yl)thio)acetic acid, Y-1896
| Molecular Formula | C13H11NO4S |
|---|---|
| Molecular Weight | 277.04 g/mol |
| LogP | 2.2326 |
| Topological Polar Surface Area | 76.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.0409 |
| Heavy Atoms | 19 |
| Complexity | 641.821 |
Chemical Identifiers
| CAS Number | 884497-65-8 |
|---|---|
| SMILES | COC1=CC2=CC(=C(N=C2C=C1)SCC(=O)O)C=O |
Product Overview
[(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid (CAS 884497-65-8), with molecular formula C13H11NO4S and molecular weight 277.04 g/mol. IUPAC: 2-(3-formyl-6-methoxyquinolin-2-yl)sulfanylacetic acid.
Chemical Property Profile of [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid
Property Insights of [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid
The XLogP value of 2.2326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid. The TPSA of 76.49 Ų falls within the moderate polarity range, balancing permeability and solubility for [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid. Following Lipinski's Rule of Five, [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid has 1 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 [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid?
The CAS number of [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid is 884497-65-8.
What is the molecular formula of [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid?
The molecular formula of [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid is C13H11NO4S.
What is the molecular weight of [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid?
The molecular weight of [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid is 277.04 g/mol.
Where can I buy [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid?
You can request a quote for [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(3-Formyl-6-methoxyquinolin-2-yl)thio]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.