4-((4-Boronophenyl)amino)-4-oxobutanoic acid
TL;DR: 4-((4-Boronophenyl)amino)-4-oxobutanoic acid (CAS 480424-95-1) is a chemical compound with molecular formula C10H12BNO5 and molecular weight 237.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-boronoanilino)-4-oxobutanoic acid
Also Known As: 4-((4-Boronophenyl)amino)-4-oxobutanoic acid, N-(4-Phenylboronic)succinamic acid, 4-Succinamidophenylboronic acid, 4-(4-boronoanilino)-4-oxobutanoic acid, BM085
| Molecular Formula | C10H12BNO5 |
|---|---|
| Molecular Weight | 237.08 g/mol |
| LogP | -0.8303 |
| Topological Polar Surface Area | 106.86 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.08086 |
| Heavy Atoms | 17 |
| Complexity | 403.6622 |
Chemical Identifiers
| CAS Number | 480424-95-1 |
|---|---|
| SMILES | B(C1=CC=C(C=C1)NC(=O)CCC(=O)O)(O)O |
Product Overview
4-((4-Boronophenyl)amino)-4-oxobutanoic acid (CAS 480424-95-1), with molecular formula C10H12BNO5 and molecular weight 237.08 g/mol. IUPAC: 4-(4-boronoanilino)-4-oxobutanoic acid.
Chemical Property Profile of 4-((4-Boronophenyl)amino)-4-oxobutanoic acid
Property Insights of 4-((4-Boronophenyl)amino)-4-oxobutanoic acid
The XLogP value of -0.8303 indicates that 4-((4-Boronophenyl)amino)-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((4-Boronophenyl)amino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-((4-Boronophenyl)amino)-4-oxobutanoic acid has 4 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-Boronophenyl)amino)-4-oxobutanoic acid?
The CAS number of 4-((4-Boronophenyl)amino)-4-oxobutanoic acid is 480424-95-1.
What is the molecular formula of 4-((4-Boronophenyl)amino)-4-oxobutanoic acid?
The molecular formula of 4-((4-Boronophenyl)amino)-4-oxobutanoic acid is C10H12BNO5.
What is the molecular weight of 4-((4-Boronophenyl)amino)-4-oxobutanoic acid?
The molecular weight of 4-((4-Boronophenyl)amino)-4-oxobutanoic acid is 237.08 g/mol.
Where can I buy 4-((4-Boronophenyl)amino)-4-oxobutanoic acid?
You can request a quote for 4-((4-Boronophenyl)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-((4-Boronophenyl)amino)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Boronophenyl)amino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.