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Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate
TL;DR: Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate (CAS 53687-85-7) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate
Also Known As: ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate, imidazo[1,2-a]pyridine-3-carboxylic acid,2-(methylthio)-,ethyl ester, Ethyl 8-methylsulfanyl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraene-9-carboxylate
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 2.2329 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 521.67896 |
Chemical Identifiers
| CAS Number | 53687-85-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N1C=CC=C2)SC |
Product Overview
Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate (CAS 53687-85-7), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate.
Chemical Property Profile of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate
Property Insights of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate
The XLogP value of 2.2329 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate. With a topological polar surface area (TPSA) of 43.6 Ų, Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate 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
Frequently Asked Questions
What is the CAS number of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate?
The CAS number of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate is 53687-85-7.
What is the molecular formula of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate?
The molecular formula of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate is C11H12N2O2S.
What is the molecular weight of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate?
The molecular weight of Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate is 236.06 g/mol.
Where can I buy Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate?
You can request a quote for Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methylsulfanylimidazo[1,2-a]pyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.