![diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate structure](/static/products/5269/5269-44-3.webp)
diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate
TL;DR: diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate (CAS 5269-44-3) is a chemical compound with molecular formula C26H28ClN3O6 and molecular weight 513.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate
Also Known As: diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate, Diethyl 5-{3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate
| Molecular Formula | C26H28ClN3O6 |
|---|---|
| Molecular Weight | 513.17 g/mol |
| LogP | 3.1475 |
| Topological Polar Surface Area | 96.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.1667 |
| Heavy Atoms | 36 |
| Complexity | 1141.7695 |
Chemical Identifiers
| CAS Number | 5269-44-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC(=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C(=O)OCC |
Product Overview
diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate (CAS 5269-44-3), with molecular formula C26H28ClN3O6 and molecular weight 513.17 g/mol. IUPAC: diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate.
Chemical Property Profile of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate
Property Insights of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate
The XLogP value of 3.1475 indicates that diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.46 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate. Following Lipinski's Rule of Five, diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate?
The CAS number of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate is 5269-44-3.
What is the molecular formula of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate?
The molecular formula of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate is C26H28ClN3O6.
What is the molecular weight of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate?
The molecular weight of diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate is 513.17 g/mol.
Where can I buy diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate?
You can request a quote for diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 5-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.