![[2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate structure](/static/products/853/853324-80-8.png)
[2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
TL;DR: [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate (CAS 853324-80-8) is a chemical compound with molecular formula C18H16Cl2N2O6S and molecular weight 458.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
Also Known As: [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate|{[5-acetyl-3-(ethoxycarbonyl)-4-methylthiophen-2-yl]carbamoyl}methyl 5,6-dichloropyridine-3-carboxylate|EN300-26616450
| Molecular Formula | C18H16Cl2N2O6S |
|---|---|
| Molecular Weight | 458.01 g/mol |
| LogP | 3.93312 |
| Topological Polar Surface Area | 111.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 458.01062 |
| Heavy Atoms | 29 |
| Complexity | 988.97125 |
Chemical Identifiers
| CAS Number | 853324-80-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl |
Product Overview
[2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate (CAS 853324-80-8), with molecular formula C18H16Cl2N2O6S and molecular weight 458.01 g/mol. IUPAC: [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate.
Chemical Property Profile of [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
Property Insights of [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
The XLogP value of 3.93312 indicates that [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.66 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate has 1 hydrogen bond donor(s) and 8 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 [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
The CAS number of [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate is 853324-80-8.
What is the molecular formula of [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
The molecular formula of [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate is C18H16Cl2N2O6S.
What is the molecular weight of [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
The molecular weight of [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate is 458.01 g/mol.
Where can I buy [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
You can request a quote for [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.