![ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE structure](/static/products/397/397288-82-3.png)
ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE
TL;DR: ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE (CAS 397288-82-3) is a chemical compound with molecular formula C21H20N4O3S and molecular weight 408.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]piperazine-1-carboxylate
Also Known As: ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE, F0816-0273, (E)-ethyl 4-(5-(2-(benzo[d]thiazol-2-yl)-2-cyanovinyl)furan-2-yl)piperazine-1-carboxylate, ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]piperazine-1-carboxylate
| Molecular Formula | C21H20N4O3S |
|---|---|
| Molecular Weight | 408.13 g/mol |
| LogP | 4.23198 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.1256 |
| Heavy Atoms | 29 |
| Complexity | 1053.7349 |
Chemical Identifiers
| CAS Number | 397288-82-3 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C2=CC=C(O2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3 |
Product Overview
ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE (CAS 397288-82-3), with molecular formula C21H20N4O3S and molecular weight 408.13 g/mol. IUPAC: ethyl 4-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]piperazine-1-carboxylate.
Chemical Property Profile of ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE
Property Insights of ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE
The XLogP value of 4.23198 indicates that ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE. Following Lipinski's Rule of Five, ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE has 0 hydrogen bond donor(s) and 7 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 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE?
The CAS number of ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE is 397288-82-3.
What is the molecular formula of ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE?
The molecular formula of ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE is C21H20N4O3S.
What is the molecular weight of ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE?
The molecular weight of ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE is 408.13 g/mol.
Where can I buy ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE?
You can request a quote for ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE?
Yes, KEHONG BIO provides custom synthesis services for ETHYL 4-{5-[(1E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-CYANOETH-1-EN-1-YL]FURAN-2-YL}PIPERAZINE-1-CARBOXYLATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.