1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
TL;DR: 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine (CAS 6252-86-4) is a chemical compound with molecular formula C21H24N4O4 and molecular weight 396.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
Also Known As: 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine, N-[(E)-{3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl}methylidene]-4H-1,2,4-triazol-4-amine
| Molecular Formula | C21H24N4O4 |
|---|---|
| Molecular Weight | 396.18 g/mol |
| LogP | 3.0334 |
| Topological Polar Surface Area | 79.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 396.17975 |
| Heavy Atoms | 29 |
| Complexity | 869.6523 |
Chemical Identifiers
| CAS Number | 6252-86-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C=NN2C=NN=C2)OCCOCCOC3=CC=CC=C3 |
Product Overview
1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine (CAS 6252-86-4), with molecular formula C21H24N4O4 and molecular weight 396.18 g/mol. IUPAC: 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine.
Chemical Property Profile of 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
Property Insights of 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine
The XLogP value of 3.0334 indicates that 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine. Following Lipinski's Rule of Five, 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine has 0 hydrogen bond donor(s) and 7 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 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine?
The CAS number of 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is 6252-86-4.
What is the molecular formula of 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine?
The molecular formula of 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is C21H24N4O4.
What is the molecular weight of 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine?
The molecular weight of 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine is 396.18 g/mol.
Where can I buy 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine?
You can request a quote for 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-ethoxy-4-[2-(2-phenoxyethoxy)ethoxy]phenyl]-N-(1,2,4-triazol-4-yl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.