![1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone structure](/static/products/491/491857-13-7.png)
1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone
TL;DR: 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone (CAS 491857-13-7) is a chemical compound with molecular formula C20H18Cl2N4O3 and molecular weight 432.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[2-(2,4-dichlorophenyl)-2-oxo-1-(1,2,4-triazol-1-yl)ethoxy]phenyl]-N-propan-2-ylmethanimine oxide
Also Known As: 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone, 1-[4-[2-(2,4-dichlorophenyl)-2-oxo-1-(1,2,4-triazol-1-yl)ethoxy]phenyl]-N-propan-2-ylmethanimine oxide
| Molecular Formula | C20H18Cl2N4O3 |
|---|---|
| Molecular Weight | 432.08 g/mol |
| LogP | 4.383 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.0756 |
| Heavy Atoms | 29 |
| Complexity | 1018.7154 |
Chemical Identifiers
| CAS Number | 491857-13-7 |
|---|---|
| SMILES | CC(C)/[N+](=C/C1=CC=C(C=C1)OC(C(=O)C2=C(C=C(C=C2)Cl)Cl)N3C=NC=N3)/[O-] |
Product Overview
1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone (CAS 491857-13-7), with molecular formula C20H18Cl2N4O3 and molecular weight 432.08 g/mol. IUPAC: 1-[4-[2-(2,4-dichlorophenyl)-2-oxo-1-(1,2,4-triazol-1-yl)ethoxy]phenyl]-N-propan-2-ylmethanimine oxide.
Chemical Property Profile of 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone
Property Insights of 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone
The XLogP value of 4.383 indicates that 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone. Following Lipinski's Rule of Five, 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone 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 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone?
The CAS number of 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone is 491857-13-7.
What is the molecular formula of 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone?
The molecular formula of 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone is C20H18Cl2N4O3.
What is the molecular weight of 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone?
The molecular weight of 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone is 432.08 g/mol.
Where can I buy 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone?
You can request a quote for 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-dichlorophenyl)-2-(4-{[isopropyl(oxido)imino]methyl}phenoxy)-2-(1H-1,2,4-triazol-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.