Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate
TL;DR: Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate (CAS 3434-13-7) is a chemical compound with molecular formula C20H33N3O2 and molecular weight 347.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[4-[(dibutylamino)diazenyl]phenyl]butanoate
Also Known As: ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate, ethyl 4-[4-[(dibutylamino)diazenyl]phenyl]butanoate
| Molecular Formula | C20H33N3O2 |
|---|---|
| Molecular Weight | 347.26 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 54.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 347.25726 |
| Heavy Atoms | 25 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 3434-13-7 |
|---|---|
| SMILES | CCCCN(CCCC)N=NC1=CC=C(C=C1)CCCC(=O)OCC |
| InChIKey | MVAZDJQMXCUBTQ-UHFFFAOYSA-N |
Product Overview
Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate (CAS 3434-13-7), with molecular formula C20H33N3O2 and molecular weight 347.26 g/mol. IUPAC: ethyl 4-[4-[(dibutylamino)diazenyl]phenyl]butanoate.
Chemical Property Profile of Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate
Property Insights of Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate
The XLogP value of 5.9 indicates that Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.3 Ų, Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate has 0 hydrogen bond donor(s) and 5 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-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate?
The CAS number of Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate is 3434-13-7.
What is the molecular formula of Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate?
The molecular formula of Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate is C20H33N3O2.
What is the molecular weight of Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate?
The molecular weight of Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate is 347.26 g/mol.
Where can I buy Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate?
You can request a quote for Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-{4-[(1e)-3,3-dibutyltriaz-1-en-1-yl]phenyl}butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.