Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate
TL;DR: Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate (CAS 338394-29-9) is a chemical compound with molecular formula C19H14Cl2N2O3 and molecular weight 388.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(2-anilinoethenyl)-3-(2,6-dichlorophenyl)-1,2-oxazole-4-carboxylate
Also Known As: methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate, methyl 5-(2-anilinoethenyl)-3-(2,6-dichlorophenyl)-1,2-oxazole-4-carboxylate, GNF-Pf-928
| Molecular Formula | C19H14Cl2N2O3 |
|---|---|
| Molecular Weight | 388.04 g/mol |
| LogP | 5.5178 |
| Topological Polar Surface Area | 64.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.03815 |
| Heavy Atoms | 26 |
| Complexity | 932.42303 |
Chemical Identifiers
| CAS Number | 338394-29-9 |
|---|---|
| SMILES | COC(=O)C1=C(ON=C1C2=C(C=CC=C2Cl)Cl)C=CNC3=CC=CC=C3 |
Product Overview
Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate (CAS 338394-29-9), with molecular formula C19H14Cl2N2O3 and molecular weight 388.04 g/mol. IUPAC: methyl 5-(2-anilinoethenyl)-3-(2,6-dichlorophenyl)-1,2-oxazole-4-carboxylate.
Chemical Property Profile of Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate
Property Insights of Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate
The XLogP value of 5.5178 indicates that Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-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 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate. Following Lipinski's Rule of Five, Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-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 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate?
The CAS number of Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate is 338394-29-9.
What is the molecular formula of Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate?
The molecular formula of Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate is C19H14Cl2N2O3.
What is the molecular weight of Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate?
The molecular weight of Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate is 388.04 g/mol.
Where can I buy Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate?
You can request a quote for Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-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 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.