Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)
TL;DR: Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) (CAS 37744-22-2) is a chemical compound with molecular formula C18H35NO4 and molecular weight 329.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[tert-butyl-(3-ethoxy-2,2-dimethyl-3-oxopropyl)amino]-2,2-dimethylpropanoate
Also Known As: diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate), 3-Biphenyl-4-yl-3-hydroxy-propionsaeure, ethyl 3-[tert-butyl-(3-ethoxy-2,2-dimethyl-3-oxopropyl)amino, ethyl 3-[tert-butyl-(3-ethoxy-2,2-dimethyl-3-oxopropyl)amino]-2,2-dimethylpropanoate, Diethyl 2,2'-[(tert-butylazanediyl)bis(methylene)]bis(2-methylpropanoate)
| Molecular Formula | C18H35NO4 |
|---|---|
| Molecular Weight | 329.26 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 329.25662 |
| Heavy Atoms | 23 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 37744-22-2 |
|---|---|
| SMILES | CCOC(=O)C(C)(C)CN(CC(C)(C)C(=O)OCC)C(C)(C)C |
| InChIKey | XSWAJINSDAXRMI-UHFFFAOYSA-N |
Product Overview
Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) (CAS 37744-22-2), with molecular formula C18H35NO4 and molecular weight 329.26 g/mol. IUPAC: ethyl 3-[tert-butyl-(3-ethoxy-2,2-dimethyl-3-oxopropyl)amino]-2,2-dimethylpropanoate.
Chemical Property Profile of Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)
Property Insights of Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)
The XLogP value of 3.5 indicates that Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) has 0 hydrogen bond donor(s) and 5 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 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)?
The CAS number of Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) is 37744-22-2.
What is the molecular formula of Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)?
The molecular formula of Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) is C18H35NO4.
What is the molecular weight of Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)?
The molecular weight of Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) is 329.26 g/mol.
Where can I buy Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)?
You can request a quote for Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate)?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 3,3'-(tert-butylimino)bis(2,2-dimethylpropanoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.