![Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate structure](/static/products/6136/613657-62-8.webp)
Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate
TL;DR: Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate (CAS 613657-62-8) is a chemical compound with molecular formula C16H14F3NO4S and molecular weight 373.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate
Also Known As: Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate, ethyl 2-(3-(trifluoromethyl)phenylsulfonamido)benzoate, AO-854/41586013, ethyl 2-[3-(trifluoromethyl)benzenesulfonamido]benzoate, ethyl 2-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)benzoate
| Molecular Formula | C16H14F3NO4S |
|---|---|
| Molecular Weight | 373.06 g/mol |
| LogP | 3.6829 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.05957 |
| Heavy Atoms | 25 |
| Complexity | 878.9437 |
Chemical Identifiers
| CAS Number | 613657-62-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F |
Product Overview
Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate (CAS 613657-62-8), with molecular formula C16H14F3NO4S and molecular weight 373.06 g/mol. IUPAC: ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate.
Chemical Property Profile of Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate
Property Insights of Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate
The XLogP value of 3.6829 indicates that Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate. Following Lipinski's Rule of Five, Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate 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 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate?
The CAS number of Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate is 613657-62-8.
What is the molecular formula of Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate?
The molecular formula of Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate is C16H14F3NO4S.
What is the molecular weight of Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate?
The molecular weight of Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate is 373.06 g/mol.
Where can I buy Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate?
You can request a quote for Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.