![{3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime structure](/static/products/861/861211-77-0.png)
{3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime
TL;DR: {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime (CAS 861211-77-0) is a chemical compound with molecular formula C23H13Cl3F3N3O2 and molecular weight 525.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2-oxazol-5-yl]-N-[(2,6-dichlorophenyl)methoxy]-1-phenylmethanimine
Also Known As: {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime, 1-[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,2-oxazol-5-yl]-N-[(2,6-dichlorophenyl)methoxy]-1-phenylmethanimine
| Molecular Formula | C23H13Cl3F3N3O2 |
|---|---|
| Molecular Weight | 525.00 g/mol |
| LogP | 7.6848 |
| Topological Polar Surface Area | 60.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 525.00256 |
| Heavy Atoms | 34 |
| Complexity | 1322.0425 |
Chemical Identifiers
| CAS Number | 861211-77-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NOCC2=C(C=CC=C2Cl)Cl)C3=CC(=NO3)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
{3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime (CAS 861211-77-0), with molecular formula C23H13Cl3F3N3O2 and molecular weight 525.00 g/mol. IUPAC: 1-[3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2-oxazol-5-yl]-N-[(2,6-dichlorophenyl)methoxy]-1-phenylmethanimine.
Chemical Property Profile of {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime
Property Insights of {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime
The XLogP value of 7.6848 indicates that {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.51 Ų falls within the moderate polarity range, balancing permeability and solubility for {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime. Following Lipinski's Rule of Five, {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime 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 {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime?
The CAS number of {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime is 861211-77-0.
What is the molecular formula of {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime?
The molecular formula of {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime is C23H13Cl3F3N3O2.
What is the molecular weight of {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime?
The molecular weight of {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime is 525.00 g/mol.
Where can I buy {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime?
You can request a quote for {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for {3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}(phenyl)methanone O-(2,6-dichlorobenzyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.