![3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid structure](/static/products/881/881489-87-8.png)
3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid
TL;DR: 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid (CAS 881489-87-8) is a chemical compound with molecular formula C13H9Br2NO4S and molecular weight 432.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2,5-dibromophenyl)sulfonylamino]benzoic acid
Also Known As: 3-{[(2,5-dibromophenyl)sulfonyl]amino}benzoic acid, 3-[(2,5-dibromophenyl)sulfonylamino]benzoic Acid, AQ-390/42425762
| Molecular Formula | C13H9Br2NO4S |
|---|---|
| Molecular Weight | 432.86 g/mol |
| LogP | 3.7106 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.8619 |
| Heavy Atoms | 21 |
| Complexity | 805.5686 |
Chemical Identifiers
| CAS Number | 881489-87-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NS(=O)(=O)C2=C(C=CC(=C2)Br)Br)C(=O)O |
Product Overview
3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid (CAS 881489-87-8), with molecular formula C13H9Br2NO4S and molecular weight 432.86 g/mol. IUPAC: 3-[(2,5-dibromophenyl)sulfonylamino]benzoic acid.
Chemical Property Profile of 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid
Property Insights of 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid
The XLogP value of 3.7106 indicates that 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid. Following Lipinski's Rule of Five, 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid has 2 hydrogen bond donor(s) and 3 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 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid?
The CAS number of 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid is 881489-87-8.
What is the molecular formula of 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid?
The molecular formula of 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid is C13H9Br2NO4S.
What is the molecular weight of 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid?
The molecular weight of 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid is 432.86 g/mol.
Where can I buy 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid?
You can request a quote for 3-{[(2,5-Dibromophenyl)sulfonyl]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 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(2,5-Dibromophenyl)sulfonyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.