![Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate structure](/static/products/119/1195768-07-0.png)
Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate
TL;DR: Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate (CAS 1195768-07-0) is a chemical compound with molecular formula C15H13F2NO4S and molecular weight 341.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(2,6-difluorophenyl)sulfonylamino]benzoate
Also Known As: ethyl 3-[(2,6-difluorophenyl)sulfonylamino]benzoate, Ethyl 3-[(2,6-difluorobenzene-1-sulfonyl)amino]benzoate, Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate, Benzoic acid, 3-[[(2,6-difluorophenyl)sulfonyl]amino]-, ethyl ester
| Molecular Formula | C15H13F2NO4S |
|---|---|
| Molecular Weight | 341.05 g/mol |
| LogP | 2.9423 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.05334 |
| Heavy Atoms | 23 |
| Complexity | 816.87054 |
Chemical Identifiers
| CAS Number | 1195768-07-0 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC=C2F)F |
Product Overview
Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate (CAS 1195768-07-0), with molecular formula C15H13F2NO4S and molecular weight 341.05 g/mol. IUPAC: ethyl 3-[(2,6-difluorophenyl)sulfonylamino]benzoate.
Chemical Property Profile of Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate
Property Insights of Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate
The XLogP value of 2.9423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate. Following Lipinski's Rule of Five, Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}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 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate?
The CAS number of Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate is 1195768-07-0.
What is the molecular formula of Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate?
The molecular formula of Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate is C15H13F2NO4S.
What is the molecular weight of Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate?
The molecular weight of Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate is 341.05 g/mol.
Where can I buy Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate?
You can request a quote for Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-{[(2,6-difluorophenyl)sulfonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.