Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide
TL;DR: Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide (CAS 877807-17-5) is a chemical compound with molecular formula C17H14N2O5S and molecular weight 358.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-oxido-3-(thiophene-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate
Also Known As: 2-(ethoxycarbonyl)-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide, ethyl 1-oxido-3-(thiophene-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate, ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide
| Molecular Formula | C17H14N2O5S |
|---|---|
| Molecular Weight | 358.06 g/mol |
| LogP | 2.4634 |
| Topological Polar Surface Area | 92.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.06235 |
| Heavy Atoms | 25 |
| Complexity | 924.18787 |
Chemical Identifiers
| CAS Number | 877807-17-5 |
|---|---|
| SMILES | CCOC(=O)C1=[N+](C2=CC=CC=C2N=C1COC(=O)C3=CC=CS3)[O-] |
Product Overview
Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide (CAS 877807-17-5), with molecular formula C17H14N2O5S and molecular weight 358.06 g/mol. IUPAC: ethyl 1-oxido-3-(thiophene-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate.
Chemical Property Profile of Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide
Property Insights of Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide
The XLogP value of 2.4634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide. The TPSA of 92.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide. Following Lipinski's Rule of Five, Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide 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 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide?
The CAS number of Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide is 877807-17-5.
What is the molecular formula of Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide?
The molecular formula of Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide is C17H14N2O5S.
What is the molecular weight of Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide?
The molecular weight of Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide is 358.06 g/mol.
Where can I buy Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide?
You can request a quote for Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-{[(thiophen-2-ylcarbonyl)oxy]methyl}quinoxaline-2-carboxylate 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.