![Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate structure](/static/products/5806/58067-54-2.webp)
Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate
TL;DR: Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate (CAS 58067-54-2) is a chemical compound with molecular formula C29H34N2O10 and molecular weight 570.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[4-[[4-[(3-ethoxy-2-ethoxycarbonyl-3-oxopropanoyl)amino]phenyl]methyl]phenyl]carbamoyl]propanedioate
Also Known As: Tetraethyl 2,2'-(methylenebis(4,1-phenyleneiminocarbonyl))bismalonate, tetraethyl 2,2'-[methylenebis(4,1-phenylenecarbamoyl)]dimalonate, Bis-[4-(2,2-bis-aethoxycarbonyl-acetylamino)-phenyl]-methan, TETRAETHYL 2,2'-[METHYLENEBIS(4,1-PHENYLENEIMINOCARBONYL)]BISMALONATE, Propanedioic acid, 2,2'-(methylenebis(4,1-phenyleneiminocarbonyl))bis-, tetraethyl ester
| Molecular Formula | C29H34N2O10 |
|---|---|
| Molecular Weight | 570.22 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 18 |
| Exact Mass | 570.2214 |
| Heavy Atoms | 41 |
| Complexity | 799.0 |
Chemical Identifiers
| CAS Number | 58067-54-2 |
|---|---|
| SMILES | CCOC(=O)C(C(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)C(C(=O)OCC)C(=O)OCC)C(=O)OCC |
| InChIKey | NLFAPZSBRVCHGP-UHFFFAOYSA-N |
Product Overview
Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate (CAS 58067-54-2), with molecular formula C29H34N2O10 and molecular weight 570.22 g/mol. IUPAC: diethyl 2-[[4-[[4-[(3-ethoxy-2-ethoxycarbonyl-3-oxopropanoyl)amino]phenyl]methyl]phenyl]carbamoyl]propanedioate.
Chemical Property Profile of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate
Property Insights of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate
The XLogP value of 5.1 indicates that Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 163.0 Ų indicates high polarity, suggesting Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate?
The CAS number of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate is 58067-54-2.
What is the molecular formula of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate?
The molecular formula of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate is C29H34N2O10.
What is the molecular weight of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate?
The molecular weight of Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate is 570.22 g/mol.
Where can I buy Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate?
You can request a quote for Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate?
Yes, KEHONG BIO provides custom synthesis services for Tetraethyl 2,2'-[methylenebis(4,1-phenyleneiminocarbonyl)]bismalonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.