3-(2-Fluorobenzenesulfonamido)propanoic acid
TL;DR: 3-(2-Fluorobenzenesulfonamido)propanoic acid (CAS 613657-21-9) is a chemical compound with molecular formula C9H10FNO4S and molecular weight 247.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-fluorophenyl)sulfonylamino]propanoic acid
Also Known As: 3-(2-fluorobenzenesulfonamido)propanoic acid, 3-((2-fluorophenyl)sulfonamido)propanoic acid, 3-[(2-fluorophenyl)sulfonylamino]propanoic Acid, 3-(2-Fluoro-benzenesulfonylamino)-propionic acid, 3-(2-fluorobenzenesulfonamido)propanoicacid
| Molecular Formula | C9H10FNO4S |
|---|---|
| Molecular Weight | 247.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.03146 |
| Heavy Atoms | 16 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 613657-21-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)F)S(=O)(=O)NCCC(=O)O |
| InChIKey | IHHDUPWVGVAAMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-Fluorobenzenesulfonamido)propanoic acid (CAS 613657-21-9), with molecular formula C9H10FNO4S and molecular weight 247.03 g/mol. IUPAC: 3-[(2-fluorophenyl)sulfonylamino]propanoic acid.
Chemical Property Profile of 3-(2-Fluorobenzenesulfonamido)propanoic acid
Property Insights of 3-(2-Fluorobenzenesulfonamido)propanoic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Fluorobenzenesulfonamido)propanoic acid. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Fluorobenzenesulfonamido)propanoic acid. Following Lipinski's Rule of Five, 3-(2-Fluorobenzenesulfonamido)propanoic acid has 2 hydrogen bond donor(s) and 6 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-Fluorobenzenesulfonamido)propanoic acid?
The CAS number of 3-(2-Fluorobenzenesulfonamido)propanoic acid is 613657-21-9.
What is the molecular formula of 3-(2-Fluorobenzenesulfonamido)propanoic acid?
The molecular formula of 3-(2-Fluorobenzenesulfonamido)propanoic acid is C9H10FNO4S.
What is the molecular weight of 3-(2-Fluorobenzenesulfonamido)propanoic acid?
The molecular weight of 3-(2-Fluorobenzenesulfonamido)propanoic acid is 247.03 g/mol.
Where can I buy 3-(2-Fluorobenzenesulfonamido)propanoic acid?
You can request a quote for 3-(2-Fluorobenzenesulfonamido)propanoic 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-Fluorobenzenesulfonamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Fluorobenzenesulfonamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.