![[(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid structure](/static/products/330/330827-48-0.png)
[(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid
TL;DR: [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid (CAS 330827-48-0) is a chemical compound with molecular formula C17H21NO3S and molecular weight 319.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-butyl-8-methoxy-2-methylquinolin-4-yl)sulfanylacetic acid
Also Known As: 2-((3-butyl-8-methoxy-2-methylquinolin-4-yl)thio)acetic acid, (3-Butyl-8-methoxy-2-methyl-quinolin-4-ylsulfanyl)-acetic acid, [(3-butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid, 2-(3-butyl-8-methoxy-2-methylquinolin-4-yl)sulfanylacetic acid
| Molecular Formula | C17H21NO3S |
|---|---|
| Molecular Weight | 319.12 g/mol |
| LogP | 4.07112 |
| Topological Polar Surface Area | 59.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 319.1242 |
| Heavy Atoms | 22 |
| Complexity | 685.1487 |
Chemical Identifiers
| CAS Number | 330827-48-0 |
|---|---|
| SMILES | CCCCC1=C(N=C2C(=C1SCC(=O)O)C=CC=C2OC)C |
Product Overview
[(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid (CAS 330827-48-0), with molecular formula C17H21NO3S and molecular weight 319.12 g/mol. IUPAC: 2-(3-butyl-8-methoxy-2-methylquinolin-4-yl)sulfanylacetic acid.
Chemical Property Profile of [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid
Property Insights of [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid
The XLogP value of 4.07112 indicates that [(3-Butyl-8-methoxy-2-methylquinolin-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 59.42 Ų, [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]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 [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid?
The CAS number of [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid is 330827-48-0.
What is the molecular formula of [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid?
The molecular formula of [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid is C17H21NO3S.
What is the molecular weight of [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid?
The molecular weight of [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid is 319.12 g/mol.
Where can I buy [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid?
You can request a quote for [(3-Butyl-8-methoxy-2-methylquinolin-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-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(3-Butyl-8-methoxy-2-methylquinolin-4-yl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.