ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate
TL;DR: ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate (CAS 1690-30-8) is a chemical compound with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate
Also Known As: ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate, ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethy, Benzoic acid, 4,4'-(tetramethyl-1,3-cyclobutanediylidenedinitrilo)di-, diethyl ester, Diethyl 4,4'-{(2,2,4,4-tetramethylcyclobutane-1,3-diylidene)bis[(E)-azanylylidene]}dibenzoate
| Molecular Formula | C26H30N2O4 |
|---|---|
| Molecular Weight | 434.22 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 77.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 434.22055 |
| Heavy Atoms | 32 |
| Complexity | 668.0 |
Chemical Identifiers
| CAS Number | 1690-30-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=C2C(C(=NC3=CC=C(C=C3)C(=O)OCC)C2(C)C)(C)C |
| InChIKey | JAPXVCXRUBQQQL-UHFFFAOYSA-N |
Product Overview
ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate (CAS 1690-30-8), with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol. IUPAC: ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate.
Chemical Property Profile of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate
Property Insights of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate
The XLogP value of 5.9 indicates that ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.3 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate. Following Lipinski's Rule of Five, ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate?
The CAS number of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate is 1690-30-8.
What is the molecular formula of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate?
The molecular formula of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate is C26H30N2O4.
What is the molecular weight of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate?
The molecular weight of ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate is 434.22 g/mol.
Where can I buy ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate?
You can request a quote for ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[[3-(4-ethoxycarbonylphenyl)imino-2,2,4,4-tetramethylcyclobutylidene]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.