Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate
TL;DR: Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate (CAS 349125-08-2) is a chemical compound with molecular formula C9H9ClN2O3 and molecular weight 228.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5-chloro-2-pyridinyl)amino]-2-oxoacetate
Also Known As: Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate, Edoxaban Impurity 55, Edoxaban Impurity 93, N-(5-Chloropyridin-2-yl)oxalaMic acid ethyl ester, Ethyl 2-(5-chloropyridin-2-ylamino)-2-oxoacetate
| Molecular Formula | C9H9ClN2O3 |
|---|---|
| Molecular Weight | 228.03 g/mol |
| LogP | 1.2366 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.03017 |
| Heavy Atoms | 15 |
| Complexity | 364.12512 |
Chemical Identifiers
| CAS Number | 349125-08-2 |
|---|---|
| SMILES | CCOC(=O)C(=O)NC1=NC=C(C=C1)Cl |
Product Overview
Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate (CAS 349125-08-2), with molecular formula C9H9ClN2O3 and molecular weight 228.03 g/mol. IUPAC: ethyl 2-[(5-chloro-2-pyridinyl)amino]-2-oxoacetate.
Chemical Property Profile of Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate
Property Insights of Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate
The XLogP value of 1.2366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate. Following Lipinski's Rule of Five, Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate has 1 hydrogen bond donor(s) and 4 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 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate?
The CAS number of Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate is 349125-08-2.
What is the molecular formula of Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate?
The molecular formula of Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate is C9H9ClN2O3.
What is the molecular weight of Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate?
The molecular weight of Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate is 228.03 g/mol.
Where can I buy Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate?
You can request a quote for Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-((5-chloropyridin-2-yl)amino)-2-oxoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.