![Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate structure](/static/products/1928/19288-86-9.webp)
Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate
TL;DR: Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate (CAS 19288-86-9) is a chemical compound with molecular formula C21H22N2O6 and molecular weight 398.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[3-(4-ethoxycarbonylanilino)-3-oxopropanoyl]amino]benzoate
Also Known As: diethyl 4,4'-(malonylbis(azanediyl))dibenzoate, UPCMLD00WDMA024580:001, diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate, BIM-0024350.P001, ethyl 4-[[3-(4-ethoxycarbonylanilino)-3-oxopropanoyl]amino]benzoate
| Molecular Formula | C21H22N2O6 |
|---|---|
| Molecular Weight | 398.15 g/mol |
| LogP | 3.0073 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 398.1478 |
| Heavy Atoms | 29 |
| Complexity | 801.54926 |
Chemical Identifiers
| CAS Number | 19288-86-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CC(=O)NC2=CC=C(C=C2)C(=O)OCC |
Product Overview
Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate (CAS 19288-86-9), with molecular formula C21H22N2O6 and molecular weight 398.15 g/mol. IUPAC: ethyl 4-[[3-(4-ethoxycarbonylanilino)-3-oxopropanoyl]amino]benzoate.
Chemical Property Profile of Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate
Property Insights of Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate
The XLogP value of 3.0073 indicates that Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate. Following Lipinski's Rule of Five, Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate has 2 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 Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate?
The CAS number of Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate is 19288-86-9.
What is the molecular formula of Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate?
The molecular formula of Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate is C21H22N2O6.
What is the molecular weight of Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate?
The molecular weight of Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate is 398.15 g/mol.
Where can I buy Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate?
You can request a quote for Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 4,4'-[(1,3-dioxopropane-1,3-diyl)diimino]dibenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.