3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid
TL;DR: 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid (CAS 568543-80-6) is a chemical compound with molecular formula C17H17ClN2O5S and molecular weight 396.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-acetamidophenyl)sulfonylamino]-3-(2-chlorophenyl)propanoic acid
Also Known As: 3-(2-chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid, 3-(4-Acetylamino-benzenesulfonylamino)-3-(2-chloro-phenyl)-propionic acid, 3-[(4-acetamidophenyl)sulfonylamino]-3-(2-chlorophenyl)propanoic Acid, 3-((4-Acetamidophenyl)sulfonamido)-3-(2-chlorophenyl)propanoic acid, 3-(2-chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoicacid
| Molecular Formula | C17H17ClN2O5S |
|---|---|
| Molecular Weight | 396.05 g/mol |
| LogP | 2.7927 |
| Topological Polar Surface Area | 112.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.05466 |
| Heavy Atoms | 26 |
| Complexity | 913.00543 |
Chemical Identifiers
| CAS Number | 568543-80-6 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C2=CC=CC=C2Cl |
Product Overview
3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid (CAS 568543-80-6), with molecular formula C17H17ClN2O5S and molecular weight 396.05 g/mol. IUPAC: 3-[(4-acetamidophenyl)sulfonylamino]-3-(2-chlorophenyl)propanoic acid.
Chemical Property Profile of 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid
Property Insights of 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid
The XLogP value of 2.7927 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid. The TPSA of 112.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid. Following Lipinski's Rule of Five, 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid has 3 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 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid?
The CAS number of 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid is 568543-80-6.
What is the molecular formula of 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid?
The molecular formula of 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid is C17H17ClN2O5S.
What is the molecular weight of 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid?
The molecular weight of 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid is 396.05 g/mol.
Where can I buy 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid?
You can request a quote for 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)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-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chlorophenyl)-3-(4-acetamidobenzenesulfonamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.