Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate
TL;DR: Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate (CAS 58337-24-9) is a chemical compound with molecular formula C13H13NO4 and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate
Also Known As: TimTec1_001582, Ethyl 2,4-dioxo-1-phenyl-3-pyrrolidinecarboxylate, ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate, ethyl 2,4-dioxo-1-phenylazolidine-3-carboxylate, AE-848/34542015
| Molecular Formula | C13H13NO4 |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 0.7816 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.08446 |
| Heavy Atoms | 18 |
| Complexity | 483.0244 |
Chemical Identifiers
| CAS Number | 58337-24-9 |
|---|---|
| SMILES | CCOC(=O)C1C(=O)CN(C1=O)C2=CC=CC=C2 |
Product Overview
Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate (CAS 58337-24-9), with molecular formula C13H13NO4 and molecular weight 247.08 g/mol. IUPAC: ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate.
Chemical Property Profile of Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate
Property Insights of Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate
The XLogP value of 0.7816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate has 0 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 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate?
The CAS number of Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate is 58337-24-9.
What is the molecular formula of Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate?
The molecular formula of Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate is C13H13NO4.
What is the molecular weight of Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate?
The molecular weight of Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate is 247.08 g/mol.
Where can I buy Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate?
You can request a quote for Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,4-dioxo-1-phenylpyrrolidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.