5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile
TL;DR: 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile (CAS 338394-19-7) is a chemical compound with molecular formula C18H11Cl2N3O and molecular weight 355.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-anilinoethenyl)-3-(2,6-dichlorophenyl)-1,2-oxazole-4-carbonitrile
Also Known As: Bionet1_000215, DivK1c_002231, CDS1_001191, 5-(2-anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile, 5-(2-anilinoethenyl)-3-(2,6-dichlorophenyl)-1,2-oxazole-4-carbonitrile
| Molecular Formula | C18H11Cl2N3O |
|---|---|
| Molecular Weight | 355.03 g/mol |
| LogP | 5.60288 |
| Topological Polar Surface Area | 61.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.02792 |
| Heavy Atoms | 24 |
| Complexity | 906.93207 |
Chemical Identifiers
| CAS Number | 338394-19-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC=CC2=C(C(=NO2)C3=C(C=CC=C3Cl)Cl)C#N |
Product Overview
5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile (CAS 338394-19-7), with molecular formula C18H11Cl2N3O and molecular weight 355.03 g/mol. IUPAC: 5-(2-anilinoethenyl)-3-(2,6-dichlorophenyl)-1,2-oxazole-4-carbonitrile.
Chemical Property Profile of 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile
Property Insights of 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile
The XLogP value of 5.60288 indicates that 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-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 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile. Following Lipinski's Rule of Five, 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-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 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile?
The CAS number of 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile is 338394-19-7.
What is the molecular formula of 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile?
The molecular formula of 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile is C18H11Cl2N3O.
What is the molecular weight of 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile?
The molecular weight of 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile is 355.03 g/mol.
Where can I buy 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile?
You can request a quote for 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Anilinovinyl)-3-(2,6-dichlorophenyl)-4-isoxazolecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.