![4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid structure](/static/products/6621/6621-87-0.webp)
4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid
TL;DR: 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid (CAS 6621-87-0) is a chemical compound with molecular formula C18H15ClO4 and molecular weight 330.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid
Also Known As: (2E)-4-(4-chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-o, 4-(4-chlorophenyl)-2-(4-methoxybenzylidene)-4-oxobutanoic acid, 4-(4-chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid
| Molecular Formula | C18H15ClO4 |
|---|---|
| Molecular Weight | 330.07 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.0659 |
| Heavy Atoms | 23 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 6621-87-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O |
| InChIKey | BXPGIWVNRUKSAB-UHFFFAOYSA-N |
Product Overview
4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid (CAS 6621-87-0), with molecular formula C18H15ClO4 and molecular weight 330.07 g/mol. IUPAC: 4-(4-chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid.
Chemical Property Profile of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid
Property Insights of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid
The XLogP value of 3.8 indicates that 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid?
The CAS number of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid is 6621-87-0.
What is the molecular formula of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid?
The molecular formula of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid is C18H15ClO4.
What is the molecular weight of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid?
The molecular weight of 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid is 330.07 g/mol.
Where can I buy 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid?
You can request a quote for 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic 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-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)methylidene]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.