Ethyl 3-benzenesulfonamidopropanoate
TL;DR: Ethyl 3-benzenesulfonamidopropanoate (CAS 51786-12-0) is a chemical compound with molecular formula C11H15NO4S and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(benzenesulfonamido)propanoate
Also Known As: ethyl 3-benzenesulfonamidopropanoate, Ethyl 3-(benzenesulfonamido)propanoate, ethyl3-benzenesulfonamidopropanoate, Ethyl N-(benzenesulfonyl)-beta-alaninate, J2.730.529F
| Molecular Formula | C11H15NO4S |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 0.9181 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 257.07217 |
| Heavy Atoms | 17 |
| Complexity | 455.6196 |
Chemical Identifiers
| CAS Number | 51786-12-0 |
|---|---|
| SMILES | CCOC(=O)CCNS(=O)(=O)C1=CC=CC=C1 |
Product Overview
Ethyl 3-benzenesulfonamidopropanoate (CAS 51786-12-0), with molecular formula C11H15NO4S and molecular weight 257.07 g/mol. IUPAC: ethyl 3-(benzenesulfonamido)propanoate.
Chemical Property Profile of Ethyl 3-benzenesulfonamidopropanoate
Property Insights of Ethyl 3-benzenesulfonamidopropanoate
The XLogP value of 0.9181 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-benzenesulfonamidopropanoate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-benzenesulfonamidopropanoate. Following Lipinski's Rule of Five, Ethyl 3-benzenesulfonamidopropanoate has 1 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 Ethyl 3-benzenesulfonamidopropanoate?
The CAS number of Ethyl 3-benzenesulfonamidopropanoate is 51786-12-0.
What is the molecular formula of Ethyl 3-benzenesulfonamidopropanoate?
The molecular formula of Ethyl 3-benzenesulfonamidopropanoate is C11H15NO4S.
What is the molecular weight of Ethyl 3-benzenesulfonamidopropanoate?
The molecular weight of Ethyl 3-benzenesulfonamidopropanoate is 257.07 g/mol.
Where can I buy Ethyl 3-benzenesulfonamidopropanoate?
You can request a quote for Ethyl 3-benzenesulfonamidopropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-benzenesulfonamidopropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-benzenesulfonamidopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.