2-Quinolin-2-ylsulfanylpropanoic acid
TL;DR: 2-Quinolin-2-ylsulfanylpropanoic acid (CAS 625855-71-2) is a chemical compound with molecular formula C12H11NO2S and molecular weight 233.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-quinolin-2-ylsulfanylpropanoic acid
Also Known As: (quinolylthio)propionic acid, 2-(2-quinolylthio)propionic acid, 2-quinolin-2-ylsulfanylpropanoic acid, 2-(2-quinolinylthio)propanoic acid, 2-(quinolin-2-ylthio)propanoic acid
| Molecular Formula | C12H11NO2S |
|---|---|
| Molecular Weight | 233.05 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 75.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.05106 |
| Heavy Atoms | 16 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 625855-71-2 |
|---|---|
| SMILES | CC(C(=O)O)SC1=NC2=CC=CC=C2C=C1 |
| InChIKey | JLYPYACZXPBHLU-UHFFFAOYSA-N |
Product Overview
2-Quinolin-2-ylsulfanylpropanoic acid (CAS 625855-71-2), with molecular formula C12H11NO2S and molecular weight 233.05 g/mol. IUPAC: 2-quinolin-2-ylsulfanylpropanoic acid.
Chemical Property Profile of 2-Quinolin-2-ylsulfanylpropanoic acid
Property Insights of 2-Quinolin-2-ylsulfanylpropanoic acid
The XLogP value of 3.0 indicates that 2-Quinolin-2-ylsulfanylpropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Quinolin-2-ylsulfanylpropanoic acid. Following Lipinski's Rule of Five, 2-Quinolin-2-ylsulfanylpropanoic 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-Quinolin-2-ylsulfanylpropanoic acid?
The CAS number of 2-Quinolin-2-ylsulfanylpropanoic acid is 625855-71-2.
What is the molecular formula of 2-Quinolin-2-ylsulfanylpropanoic acid?
The molecular formula of 2-Quinolin-2-ylsulfanylpropanoic acid is C12H11NO2S.
What is the molecular weight of 2-Quinolin-2-ylsulfanylpropanoic acid?
The molecular weight of 2-Quinolin-2-ylsulfanylpropanoic acid is 233.05 g/mol.
Where can I buy 2-Quinolin-2-ylsulfanylpropanoic acid?
You can request a quote for 2-Quinolin-2-ylsulfanylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Quinolin-2-ylsulfanylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Quinolin-2-ylsulfanylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.