ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate
TL;DR: ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate (CAS 18707-19-2) is a chemical compound with molecular formula C22H25N3O5 and molecular weight 411.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate
Also Known As: ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate, 3-Pyridinepropionic acid, .beta.-[2-carboxy-5-oxo-3-(3-pyridyl)-2-pyrrolidinyl]-, diethyl ester, beta-[2-(Ethoxycarbonyl)-5-oxo-3-(3-pyridinyl)-2-pyrrolidinyl]-3-pyridinepropionic acid ethyl ester, 3-Pyridinepropanoic acid, .beta.-[2-(ethoxycarbonyl)-5-oxo-3-(3-pyridinyl)-2-pyrrolidinyl]-, ethyl ester, Ethyl 2-[3-ethoxy-3-oxo-1-(3-pyridinyl)propyl]-5-oxo-3-(3-pyridinyl)-2-pyrrolidinecarboxylate #
| Molecular Formula | C22H25N3O5 |
|---|---|
| Molecular Weight | 411.18 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 411.1794 |
| Heavy Atoms | 30 |
| Complexity | 628.0 |
Chemical Identifiers
| CAS Number | 18707-19-2 |
|---|---|
| SMILES | CCOC(=O)CC(C1=CN=CC=C1)C2(C(CC(=O)N2)C3=CN=CC=C3)C(=O)OCC |
| InChIKey | QFQVZZNQWCAWNX-UHFFFAOYSA-N |
Product Overview
ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate (CAS 18707-19-2), with molecular formula C22H25N3O5 and molecular weight 411.18 g/mol. IUPAC: ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate.
Chemical Property Profile of ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate
Property Insights of ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate. Following Lipinski's Rule of Five, ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate has 1 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 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate?
The CAS number of ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate is 18707-19-2.
What is the molecular formula of ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate?
The molecular formula of ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate is C22H25N3O5.
What is the molecular weight of ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate?
The molecular weight of ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate is 411.18 g/mol.
Where can I buy ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate?
You can request a quote for ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-(3-ethoxy-3-oxo-1-pyridin-3-ylpropyl)-5-oxo-3-pyridin-3-ylpyrrolidine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.