![3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid structure](/static/products/369/369392-97-2.png)
3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid
TL;DR: 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid (CAS 369392-97-2) is a chemical compound with molecular formula C17H20BrNO2S and molecular weight 381.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6-bromo-3-butyl-2-methylquinolin-4-yl)sulfanylpropanoic acid
Also Known As: TimTec1_004638, A2769/0117339, 3-(6-bromo-3-butyl-2-methyl-4-quinolylthio)propanoic acid, 3-[(6-bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid, 3-((6-bromo-3-butyl-2-methylquinolin-4-yl)thio)propanoic acid
| Molecular Formula | C17H20BrNO2S |
|---|---|
| Molecular Weight | 381.04 g/mol |
| LogP | 5.21512 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.0398 |
| Heavy Atoms | 22 |
| Complexity | 687.90356 |
Chemical Identifiers
| CAS Number | 369392-97-2 |
|---|---|
| SMILES | CCCCC1=C(N=C2C=CC(=CC2=C1SCCC(=O)O)Br)C |
Product Overview
3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid (CAS 369392-97-2), with molecular formula C17H20BrNO2S and molecular weight 381.04 g/mol. IUPAC: 3-(6-bromo-3-butyl-2-methylquinolin-4-yl)sulfanylpropanoic acid.
Chemical Property Profile of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid
Property Insights of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid
The XLogP value of 5.21512 indicates that 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic 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-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid?
The CAS number of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid is 369392-97-2.
What is the molecular formula of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid?
The molecular formula of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid is C17H20BrNO2S.
What is the molecular weight of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid?
The molecular weight of 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid is 381.04 g/mol.
Where can I buy 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid?
You can request a quote for 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(6-Bromo-3-butyl-2-methylquinolin-4-yl)sulfanyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.