![3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile structure](/static/products/3384/338402-67-8.webp)
3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile
TL;DR: 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile (CAS 338402-67-8) is a chemical compound with molecular formula C19H10Cl2F3N3O and molecular weight 423.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,6-dichlorophenyl)-5-[2-[2-(trifluoromethyl)anilino]ethenyl]-1,2-oxazole-4-carbonitrile
Also Known As: 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile, 3-(2,6-dichlorophenyl)-5-[2-[[2-(trifluoromethyl)phenyl]amino]ethenyl]-1,2-oxazole-4-carbonitrile, 3-(2,6-dichlorophenyl)-5-[2-[2-(trifluoromethyl)anilino]ethenyl]-1,2-oxazole-4-carbonitrile
| Molecular Formula | C19H10Cl2F3N3O |
|---|---|
| Molecular Weight | 423.02 g/mol |
| LogP | 6.62168 |
| Topological Polar Surface Area | 61.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.0153 |
| Heavy Atoms | 28 |
| Complexity | 1064.5084 |
Chemical Identifiers
| CAS Number | 338402-67-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)NC=CC2=C(C(=NO2)C3=C(C=CC=C3Cl)Cl)C#N |
Product Overview
3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile (CAS 338402-67-8), with molecular formula C19H10Cl2F3N3O and molecular weight 423.02 g/mol. IUPAC: 3-(2,6-dichlorophenyl)-5-[2-[2-(trifluoromethyl)anilino]ethenyl]-1,2-oxazole-4-carbonitrile.
Chemical Property Profile of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile
Property Insights of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile
The XLogP value of 6.62168 indicates that 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile. Following Lipinski's Rule of Five, 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile?
The CAS number of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile is 338402-67-8.
What is the molecular formula of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile?
The molecular formula of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile is C19H10Cl2F3N3O.
What is the molecular weight of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile?
The molecular weight of 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile is 423.02 g/mol.
Where can I buy 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile?
You can request a quote for 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,6-dichlorophenyl)-5-{2-[2-(trifluoromethyl)anilino]vinyl}-4-isoxazolecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.