![ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate structure](/static/products/340/340032-96-4.png)
ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate
TL;DR: ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate (CAS 340032-96-4) is a chemical compound with molecular formula C17H15F5N2O4S and molecular weight 438.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(benzenesulfonamido)-2-(3,4-difluoroanilino)-3,3,3-trifluoropropanoate
Also Known As: ethyl 2-((3,4-difluorophenyl)amino)-3,3,3-trifluoro-2-(phenylsulfonamido)propanoate, ethyl 2-(benzenesulfonamido)-2-(3,4-difluoroanilino)-3,3,3-trifluoropropanoate, ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate
| Molecular Formula | C17H15F5N2O4S |
|---|---|
| Molecular Weight | 438.07 g/mol |
| LogP | 3.1769 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 438.06726 |
| Heavy Atoms | 29 |
| Complexity | 983.0629 |
Chemical Identifiers
| CAS Number | 340032-96-4 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=CC(=C(C=C1)F)F)NS(=O)(=O)C2=CC=CC=C2 |
Product Overview
ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate (CAS 340032-96-4), with molecular formula C17H15F5N2O4S and molecular weight 438.07 g/mol. IUPAC: ethyl 2-(benzenesulfonamido)-2-(3,4-difluoroanilino)-3,3,3-trifluoropropanoate.
Chemical Property Profile of ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate
Property Insights of ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate
The XLogP value of 3.1769 indicates that ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate. Following Lipinski's Rule of Five, ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate 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 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate?
The CAS number of ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate is 340032-96-4.
What is the molecular formula of ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate?
The molecular formula of ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate is C17H15F5N2O4S.
What is the molecular weight of ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate?
The molecular weight of ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate is 438.07 g/mol.
Where can I buy ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate?
You can request a quote for ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(3,4-difluorophenyl)amino]-3,3,3-trifluoro-N-(phenylsulfonyl)alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.