4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid
TL;DR: 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid (CAS 52716-37-7) is a chemical compound with molecular formula C14H10BrNO3 and molecular weight 318.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-bromo-2-hydroxyphenyl)methylideneamino]benzoic acid
Also Known As: 4-((5-BROMO-2-HYDROXY-BENZYLIDENE)-AMINO)-BENZOIC ACID, 4-(5-bromo-2-hydroxy-benzylidenamino)-benzoic acid, 4-[(1E)-2-(5-bromo-2-hydroxyphenyl)-1-azavinyl]benzoic acid, 4-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzoic Acid, 4-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoic acid
| Molecular Formula | C14H10BrNO3 |
|---|---|
| Molecular Weight | 318.98 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.9844 |
| Heavy Atoms | 19 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 52716-37-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)N=CC2=C(C=CC(=C2)Br)O |
| InChIKey | DPNSNZZTWGHWJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid (CAS 52716-37-7), with molecular formula C14H10BrNO3 and molecular weight 318.98 g/mol. IUPAC: 4-[(5-bromo-2-hydroxyphenyl)methylideneamino]benzoic acid.
Chemical Property Profile of 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid
Property Insights of 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid
The XLogP value of 3.1 indicates that 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid. Following Lipinski's Rule of Five, 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid has 2 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-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid?
The CAS number of 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid is 52716-37-7.
What is the molecular formula of 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid?
The molecular formula of 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid is C14H10BrNO3.
What is the molecular weight of 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid?
The molecular weight of 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid is 318.98 g/mol.
Where can I buy 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid?
You can request a quote for 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-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-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((5-Bromo-2-hydroxy-benzylidene)-amino)-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.