![ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate structure](/static/products/384/384359-62-0.png)
ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate
TL;DR: ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate (CAS 384359-62-0) is a chemical compound with molecular formula C25H29N5O4S and molecular weight 495.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]quinoxalin-2-yl]piperazine-1-carboxylate
Also Known As: ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate, ethyl 4-(3-{[3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}quinoxalin-2-yl)piperazine-1-carboxylate, ethyl 4-[3-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]quinoxalin-2-yl]piperazine-1-carboxylate
| Molecular Formula | C25H29N5O4S |
|---|---|
| Molecular Weight | 495.19 g/mol |
| LogP | 4.3788 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.19403 |
| Heavy Atoms | 35 |
| Complexity | 1252.1282 |
Chemical Identifiers
| CAS Number | 384359-62-0 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3N=C2NC4=C(C5=C(S4)CCCC5)C(=O)OC |
Product Overview
ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate (CAS 384359-62-0), with molecular formula C25H29N5O4S and molecular weight 495.19 g/mol. IUPAC: ethyl 4-[3-[(3-methoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]quinoxalin-2-yl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate
Property Insights of ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate
The XLogP value of 4.3788 indicates that ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate has 1 hydrogen bond donor(s) and 9 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-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate?
The CAS number of ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate is 384359-62-0.
What is the molecular formula of ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate?
The molecular formula of ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate is C25H29N5O4S.
What is the molecular weight of ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate?
The molecular weight of ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate is 495.19 g/mol.
Where can I buy ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate?
You can request a quote for ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-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-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(3-((3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)quinoxalin-2-yl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.