![[(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid structure](/static/products/6058/6058-41-9.webp)
[(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid
TL;DR: [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid (CAS 6058-41-9) is a chemical compound with molecular formula C15H17NO2S and molecular weight 275.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-ethyl-2,6-dimethylquinolin-4-yl)sulfanylacetic acid
Also Known As: BAS 01585600, BIM-0007864.P001, 2-((3-ethyl-2,6-dimethylquinolin-4-yl)thio)acetic acid, (3-Ethyl-2,6-dimethyl-quinolin-4-ylsulfanyl)-acetic acid, [(3-ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid
| Molecular Formula | C15H17NO2S |
|---|---|
| Molecular Weight | 275.10 g/mol |
| LogP | 3.59074 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.098 |
| Heavy Atoms | 19 |
| Complexity | 637.5684 |
Chemical Identifiers
| CAS Number | 6058-41-9 |
|---|---|
| SMILES | CCC1=C(N=C2C=CC(=CC2=C1SCC(=O)O)C)C |
Product Overview
[(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid (CAS 6058-41-9), with molecular formula C15H17NO2S and molecular weight 275.10 g/mol. IUPAC: 2-(3-ethyl-2,6-dimethylquinolin-4-yl)sulfanylacetic acid.
Chemical Property Profile of [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid
Property Insights of [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid
The XLogP value of 3.59074 indicates that [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.19 Ų, [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid has 1 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 [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid?
The CAS number of [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid is 6058-41-9.
What is the molecular formula of [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid?
The molecular formula of [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid is C15H17NO2S.
What is the molecular weight of [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid?
The molecular weight of [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid is 275.10 g/mol.
Where can I buy [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid?
You can request a quote for [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]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-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(3-Ethyl-2,6-dimethylquinolin-4-yl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.