Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate
TL;DR: Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate (CAS 819801-96-2) is a chemical compound with molecular formula C15H20N2O5S and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-oxo-4-[4-(prop-2-enylsulfamoyl)anilino]butanoate
Also Known As: ethyl 4-({4-[(allylamino)sulfonyl]phenyl}amino)-4-oxobutanoate, ethyl 4-oxo-4-[4-(prop-2-enylsulfamoyl)anilino]butanoate, ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate
| Molecular Formula | C15H20N2O5S |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 1.4327 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 340.10928 |
| Heavy Atoms | 23 |
| Complexity | 652.94977 |
Chemical Identifiers
| CAS Number | 819801-96-2 |
|---|---|
| SMILES | CCOC(=O)CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC=C |
Product Overview
Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate (CAS 819801-96-2), with molecular formula C15H20N2O5S and molecular weight 340.11 g/mol. IUPAC: ethyl 4-oxo-4-[4-(prop-2-enylsulfamoyl)anilino]butanoate.
Chemical Property Profile of Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate
Property Insights of Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate
The XLogP value of 1.4327 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate. Following Lipinski's Rule of Five, Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate has 2 hydrogen bond donor(s) and 5 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 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate?
The CAS number of Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate is 819801-96-2.
What is the molecular formula of Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate?
The molecular formula of Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate is C15H20N2O5S.
What is the molecular weight of Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate?
The molecular weight of Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate is 340.11 g/mol.
Where can I buy Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate?
You can request a quote for Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-oxo-4-{[4-(prop-2-en-1-ylsulfamoyl)phenyl]amino}butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.