2-(3-Methylquinoxalin-2-ylthio)acetic acid
TL;DR: 2-(3-Methylquinoxalin-2-ylthio)acetic acid (CAS 85516-14-9) is a chemical compound with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methylquinoxalin-2-yl)sulfanylacetic acid
Also Known As: IFLab1_000544, 2-(3-methylquinoxalin-2-ylthio)acetic acid, IDI1_008763, [(3-Methyl-2-quinoxalinyl)thio]acetic acid, Acetic acid, 2-[(3-methyl-2-quinoxalinyl)thio]-
| Molecular Formula | C11H10N2O2S |
|---|---|
| Molecular Weight | 234.05 g/mol |
| LogP | 2.11492 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.0463 |
| Heavy Atoms | 16 |
| Complexity | 542.49567 |
Chemical Identifiers
| CAS Number | 85516-14-9 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2N=C1SCC(=O)O |
Product Overview
2-(3-Methylquinoxalin-2-ylthio)acetic acid (CAS 85516-14-9), with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol. IUPAC: 2-(3-methylquinoxalin-2-yl)sulfanylacetic acid.
Chemical Property Profile of 2-(3-Methylquinoxalin-2-ylthio)acetic acid
Property Insights of 2-(3-Methylquinoxalin-2-ylthio)acetic acid
The XLogP value of 2.11492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Methylquinoxalin-2-ylthio)acetic acid. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Methylquinoxalin-2-ylthio)acetic acid. Following Lipinski's Rule of Five, 2-(3-Methylquinoxalin-2-ylthio)acetic acid has 1 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-(3-Methylquinoxalin-2-ylthio)acetic acid?
The CAS number of 2-(3-Methylquinoxalin-2-ylthio)acetic acid is 85516-14-9.
What is the molecular formula of 2-(3-Methylquinoxalin-2-ylthio)acetic acid?
The molecular formula of 2-(3-Methylquinoxalin-2-ylthio)acetic acid is C11H10N2O2S.
What is the molecular weight of 2-(3-Methylquinoxalin-2-ylthio)acetic acid?
The molecular weight of 2-(3-Methylquinoxalin-2-ylthio)acetic acid is 234.05 g/mol.
Where can I buy 2-(3-Methylquinoxalin-2-ylthio)acetic acid?
You can request a quote for 2-(3-Methylquinoxalin-2-ylthio)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-(3-Methylquinoxalin-2-ylthio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Methylquinoxalin-2-ylthio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.