![5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid structure](/static/products/546/5467-97-0.png)
5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid
TL;DR: 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid (CAS 5467-97-0) is a chemical compound with molecular formula C24H19BrN2O6 and molecular weight 510.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid
Also Known As: 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid
| Molecular Formula | C24H19BrN2O6 |
|---|---|
| Molecular Weight | 510.04 g/mol |
| LogP | 5.26368 |
| Topological Polar Surface Area | 121.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 510.04266 |
| Heavy Atoms | 33 |
| Complexity | 1224.4966 |
Chemical Identifiers
| CAS Number | 5467-97-0 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)Br)OCC3=CC=C(O3)C(=O)O |
Product Overview
5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid (CAS 5467-97-0), with molecular formula C24H19BrN2O6 and molecular weight 510.04 g/mol. IUPAC: 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid.
Chemical Property Profile of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid
Property Insights of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid
The XLogP value of 5.26368 indicates that 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid. Following Lipinski's Rule of Five, 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid?
The CAS number of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid is 5467-97-0.
What is the molecular formula of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid?
The molecular formula of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid is C24H19BrN2O6.
What is the molecular weight of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid?
The molecular weight of 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid is 510.04 g/mol.
Where can I buy 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid?
You can request a quote for 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[[4-[3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.