Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate
TL;DR: Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate (CAS 498531-31-0) is a chemical compound with molecular formula C16H20N2O5 and molecular weight 320.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]amino]acetate
Also Known As: BAS 00417501, ethyl N-[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]glycinate, ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate, ethyl 2-[[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]amino]acetate, [1-(4-Ethoxy-phenyl)-2,5-dioxo-pyrrolidin-3-ylamino]-acetic acid ethyl ester
| Molecular Formula | C16H20N2O5 |
|---|---|
| Molecular Weight | 320.14 g/mol |
| LogP | 0.8699 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 320.1372 |
| Heavy Atoms | 23 |
| Complexity | 584.6383 |
Chemical Identifiers
| CAS Number | 498531-31-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC(=O)OCC |
Product Overview
Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate (CAS 498531-31-0), with molecular formula C16H20N2O5 and molecular weight 320.14 g/mol. IUPAC: ethyl 2-[[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]amino]acetate.
Chemical Property Profile of Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate
Property Insights of Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate
The XLogP value of 0.8699 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate. Following Lipinski's Rule of Five, Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate has 1 hydrogen bond donor(s) and 6 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-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate?
The CAS number of Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate is 498531-31-0.
What is the molecular formula of Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate?
The molecular formula of Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate is C16H20N2O5.
What is the molecular weight of Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate?
The molecular weight of Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate is 320.14 g/mol.
Where can I buy Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate?
You can request a quote for Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-((1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl)amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.