ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate
TL;DR: ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate (CAS 371939-86-5) is a chemical compound with molecular formula C21H19F3N4O5S2 and molecular weight 528.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-benzamido-3,3,3-trifluoro-2-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]propanoate
Also Known As: ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate, ethyl 2-benzamido-3,3,3-trifluoro-2-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]propanoate, ethyl 3,3,3-trifluoro-N-(phenylcarbonyl)-2-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino}alaninate
| Molecular Formula | C21H19F3N4O5S2 |
|---|---|
| Molecular Weight | 528.07 g/mol |
| LogP | 3.6075 |
| Topological Polar Surface Area | 126.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 528.0749 |
| Heavy Atoms | 35 |
| Complexity | 1268.5487 |
Chemical Identifiers
| CAS Number | 371939-86-5 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CS2)NC(=O)C3=CC=CC=C3 |
Product Overview
ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate (CAS 371939-86-5), with molecular formula C21H19F3N4O5S2 and molecular weight 528.07 g/mol. IUPAC: ethyl 2-benzamido-3,3,3-trifluoro-2-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]propanoate.
Chemical Property Profile of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate
Property Insights of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate
The XLogP value of 3.6075 indicates that ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.49 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate. Following Lipinski's Rule of Five, ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate?
The CAS number of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate is 371939-86-5.
What is the molecular formula of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate?
The molecular formula of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate is C21H19F3N4O5S2.
What is the molecular weight of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate?
The molecular weight of ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate is 528.07 g/mol.
Where can I buy ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate?
You can request a quote for ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-benzamido-3,3,3-trifluoro-2-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.