![4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid structure](/static/products/4384/438453-01-1.webp)
4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid
TL;DR: 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid (CAS 438453-01-1) is a chemical compound with molecular formula C10H9Br2NO3 and molecular weight 348.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,4-dibromoanilino)-4-oxobutanoic acid
Also Known As: 3-[(2,4-dibromophenyl)carbamoyl]propanoic Acid, 4-(2,4-dibromoanilino)-4-oxobutanoic acid, 4-[(2,4-dibromophenyl)amino]-4-oxobutanoic acid, butanoic acid, 4-[(2,4-dibromophenyl)amino]-4-oxo-, 3-[N-(2,4-dibromophenyl)carbamoyl]propanoic acid
| Molecular Formula | C10H9Br2NO3 |
|---|---|
| Molecular Weight | 348.89 g/mol |
| LogP | 3.0149 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.89493 |
| Heavy Atoms | 16 |
| Complexity | 420.5252 |
Chemical Identifiers
| CAS Number | 438453-01-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)Br)NC(=O)CCC(=O)O |
Product Overview
4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid (CAS 438453-01-1), with molecular formula C10H9Br2NO3 and molecular weight 348.89 g/mol. IUPAC: 4-(2,4-dibromoanilino)-4-oxobutanoic acid.
Chemical Property Profile of 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid
Property Insights of 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid
The XLogP value of 3.0149 indicates that 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid has 2 hydrogen bond donor(s) and 2 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-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid?
The CAS number of 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid is 438453-01-1.
What is the molecular formula of 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid?
The molecular formula of 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid is C10H9Br2NO3.
What is the molecular weight of 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid?
The molecular weight of 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid is 348.89 g/mol.
Where can I buy 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid?
You can request a quote for 4-[(2,4-Dibromophenyl)amino]-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-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,4-Dibromophenyl)amino]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.