![4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid structure](/static/products/3402/340220-60-2.webp)
4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid
TL;DR: 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid (CAS 340220-60-2) is a chemical compound with molecular formula C24H17ClN2O4 and molecular weight 432.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-[(E)-3-(4-chloroanilino)-2-cyano-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid
Also Known As: 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid, 4-[[4-[(E)-3-(4-chloroanilino)-2-cyano-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid, 4-[[4-[2-[(4-chlorophenyl)carbamoyl]-2-cyano-ethenyl]phenoxy]methyl]benzoic Acid
| Molecular Formula | C24H17ClN2O4 |
|---|---|
| Molecular Weight | 432.09 g/mol |
| LogP | 5.16288 |
| Topological Polar Surface Area | 99.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.08768 |
| Heavy Atoms | 31 |
| Complexity | 1146.1837 |
Chemical Identifiers
| CAS Number | 340220-60-2 |
|---|---|
| SMILES | C1=CC(=CC=C1COC2=CC=C(C=C2)/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)Cl)C(=O)O |
Product Overview
4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid (CAS 340220-60-2), with molecular formula C24H17ClN2O4 and molecular weight 432.09 g/mol. IUPAC: 4-[[4-[(E)-3-(4-chloroanilino)-2-cyano-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid.
Chemical Property Profile of 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid
Property Insights of 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid
The XLogP value of 5.16288 indicates that 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid. Following Lipinski's Rule of Five, 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid has 2 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 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid?
The CAS number of 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid is 340220-60-2.
What is the molecular formula of 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid?
The molecular formula of 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid is C24H17ClN2O4.
What is the molecular weight of 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid?
The molecular weight of 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid is 432.09 g/mol.
Where can I buy 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid?
You can request a quote for 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-{2-[(4-chlorophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}phenoxy)methyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.