![methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate structure](/static/products/3384/338417-59-7.webp)
methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate
TL;DR: methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate (CAS 338417-59-7) is a chemical compound with molecular formula C19H12Cl3FN2O3 and molecular weight 439.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)ethenyl]-1,2-oxazole-4-carboxylate
Also Known As: methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate, methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)ethenyl]-1,2-oxazole-4-carboxylate
| Molecular Formula | C19H12Cl3FN2O3 |
|---|---|
| Molecular Weight | 439.99 g/mol |
| LogP | 6.3103 |
| Topological Polar Surface Area | 64.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.98975 |
| Heavy Atoms | 28 |
| Complexity | 1046.3225 |
Chemical Identifiers
| CAS Number | 338417-59-7 |
|---|---|
| SMILES | COC(=O)C1=C(ON=C1C2=C(C=CC=C2Cl)F)C=CNC3=C(C=C(C=C3)Cl)Cl |
Product Overview
methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate (CAS 338417-59-7), with molecular formula C19H12Cl3FN2O3 and molecular weight 439.99 g/mol. IUPAC: methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)ethenyl]-1,2-oxazole-4-carboxylate.
Chemical Property Profile of methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate
Property Insights of methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate
The XLogP value of 6.3103 indicates that methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.36 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate. Following Lipinski's Rule of Five, methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate has 1 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 methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate?
The CAS number of methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate is 338417-59-7.
What is the molecular formula of methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate?
The molecular formula of methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate is C19H12Cl3FN2O3.
What is the molecular weight of methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate?
The molecular weight of methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate is 439.99 g/mol.
Where can I buy methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate?
You can request a quote for methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(2-chloro-6-fluorophenyl)-5-[2-(2,4-dichloroanilino)vinyl]-4-isoxazolecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.