3-Amino-4-phenoxy-5-sulfamoylbenzoic acid
TL;DR: 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid (CAS 28328-54-3) is a chemical compound with molecular formula C13H12N2O5S and molecular weight 308.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-phenoxy-5-sulfamoylbenzoic acid
Also Known As: Desbutyl Bumetanide, 3-amino-4-phenoxy-5-sulfamoylbenzoic acid, Desbutylbumetanide, Not Available, Bumetanide EP Impurity B
| Molecular Formula | C13H12N2O5S |
|---|---|
| Molecular Weight | 308.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.0467 |
| Heavy Atoms | 21 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 28328-54-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)N |
| InChIKey | GVQZPZSQRCXSJI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-4-phenoxy-5-sulfamoylbenzoic acid (CAS 28328-54-3), with molecular formula C13H12N2O5S and molecular weight 308.05 g/mol. IUPAC: 3-amino-4-phenoxy-5-sulfamoylbenzoic acid.
Chemical Property Profile of 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid
Property Insights of 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid. The TPSA of 141.0 Ų indicates high polarity, suggesting 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid has 3 hydrogen bond donor(s) and 7 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-Amino-4-phenoxy-5-sulfamoylbenzoic acid?
The CAS number of 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid is 28328-54-3.
What is the molecular formula of 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid?
The molecular formula of 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid is C13H12N2O5S.
What is the molecular weight of 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid?
The molecular weight of 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid is 308.05 g/mol.
Where can I buy 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid?
You can request a quote for 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-4-phenoxy-5-sulfamoylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.