![Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate structure](/static/products/810/81022-12-0.png)
Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate
TL;DR: Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate (CAS 81022-12-0) is a chemical compound with molecular formula C13H12N2O4S2 and molecular weight 324.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methylsulfonylimidazo[2,1-b][1,3]benzothiazole-2-carboxylate
Also Known As: ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate, Ethyl 7-(methylsulfonyl)benzo[d]imidazo[2,1-b]thiazole-2-carboxylate, ethyl 6-methylsulfonylimidazo[2,1-b][1,3]benzothiazole-2-carboxylate, ethylmethylsulfonylimidazobbenzothiazolecarboxylate, Ethyl 7-(methylsulfonyl)imidazo-[2,1-b][1,3]benzothiazole-2-carboxylate
| Molecular Formula | C13H12N2O4S2 |
|---|---|
| Molecular Weight | 324.02 g/mol |
| LogP | 2.1292 |
| Topological Polar Surface Area | 77.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.02383 |
| Heavy Atoms | 21 |
| Complexity | 953.2772 |
Chemical Identifiers
| CAS Number | 81022-12-0 |
|---|---|
| SMILES | CCOC(=O)C1=CN2C3=C(C=C(C=C3)S(=O)(=O)C)SC2=N1 |
Product Overview
Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate (CAS 81022-12-0), with molecular formula C13H12N2O4S2 and molecular weight 324.02 g/mol. IUPAC: ethyl 6-methylsulfonylimidazo[2,1-b][1,3]benzothiazole-2-carboxylate.
Chemical Property Profile of Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate
Property Insights of Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate
The XLogP value of 2.1292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate. The TPSA of 77.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate has 0 hydrogen bond donor(s) and 6 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 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate?
The CAS number of Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate is 81022-12-0.
What is the molecular formula of Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate?
The molecular formula of Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate is C13H12N2O4S2.
What is the molecular weight of Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate?
The molecular weight of Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate is 324.02 g/mol.
Where can I buy Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate?
You can request a quote for Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 7-(methylsulfonyl)imidazo[2,1-b][1,3]benzothiazole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.