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Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate
TL;DR: Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate (CAS 107456-73-5) is a chemical compound with molecular formula C14H15NO2S and molecular weight 261.08234 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(2-methylquinolin-4-yl)sulfanylacetate
Also Known As: BIM-0031986.P001, ethyl 2-((2-methylquinolin-4-yl)thio)acetate, ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate, ethyl 2-(2-methylquinolin-4-yl)sulfanylacetate
Technical Specifications
| Molecular Formula | C14H15NO2S |
| Molecular Weight | 261.08234 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 64.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.08234 Da |
| Heavy Atoms | 18 |
| Complexity | 285.0 |
| SMILES | CCOC(=O)CSC1=CC(=NC2=CC=CC=C21)C |
| InChIKey | CFFQZXRFKBNHCS-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate
Property Insights of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate
The XLogP value of 3.6 indicates that Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate. Following Lipinski's Rule of Five, Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate?
The CAS number of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate is 107456-73-5.
What is the molecular formula of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate?
The molecular formula of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate is C14H15NO2S.
What is the molecular weight of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate?
The molecular weight of Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate is 261.08234 g/mol.
Where can I buy Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate?
You can request a quote for Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate?
Yes, CoreyChem provides custom synthesis services for Ethyl [(2-methylquinolin-4-yl)sulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.