![ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate structure](/static/products/4707/4707-72-6.webp)
ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate
TL;DR: ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate (CAS 4707-72-6) is a chemical compound with molecular formula C9H9NO2S and molecular weight 195.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate
Also Known As: ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate, Ethyl 4H-Thieno[2,3-d]Pyrrole-5-Carboxylate, ethylthienobpyrrolecarboxylate, D-Amino acid oxidase inhibitor, 1H-benzimidazole-4-carboxylic acid
| Molecular Formula | C9H9NO2S |
|---|---|
| Molecular Weight | 195.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 70.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.0354 |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 4707-72-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N1)C=CS2 |
| InChIKey | BLUDZFMRKHHPGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate (CAS 4707-72-6), with molecular formula C9H9NO2S and molecular weight 195.04 g/mol. IUPAC: ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate.
Chemical Property Profile of ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate
Property Insights of ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate. Following Lipinski's Rule of Five, ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate has 1 hydrogen bond donor(s) and 3 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 4H-thieno[3,2-b]pyrrole-5-carboxylate?
The CAS number of ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate is 4707-72-6.
What is the molecular formula of ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate?
The molecular formula of ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate is C9H9NO2S.
What is the molecular weight of ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate?
The molecular weight of ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate is 195.04 g/mol.
Where can I buy ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate?
You can request a quote for ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4H-thieno[3,2-b]pyrrole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.