![Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate structure](/static/products/256/256326-04-2.png)
Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate
TL;DR: Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate (CAS 256326-04-2) is a chemical compound with molecular formula C18H15F6N3O3 and molecular weight 435.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-(pyridine-3-carbonylamino)-2-[2-(trifluoromethyl)anilino]propanoate
Also Known As: A1588/0068941, ethyl 3,3,3-trifluoro-2-(nicotinamido)-2-((2-(trifluoromethyl)phenyl)amino)propanoate, ethyl 3,3,3-trifluoro-2-(pyridine-3-carbonylamino)-2-[2-(trifluoromethyl)anilino]propanoate, Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate, ethyl 3,3,3-trifluoro-2-(3-pyridylcarbonylamino)-2-{[2-(trifluoromethyl)phenyl ]amino}propanoate
| Molecular Formula | C18H15F6N3O3 |
|---|---|
| Molecular Weight | 435.10 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 435.10175 |
| Heavy Atoms | 30 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 256326-04-2 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=CC=CC=C1C(F)(F)F)NC(=O)C2=CN=CC=C2 |
| InChIKey | WJQOFFYUMRXVCV-UHFFFAOYSA-N |
Product Overview
Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate (CAS 256326-04-2), with molecular formula C18H15F6N3O3 and molecular weight 435.10 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-(pyridine-3-carbonylamino)-2-[2-(trifluoromethyl)anilino]propanoate.
Chemical Property Profile of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate
Property Insights of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate
The XLogP value of 4.6 indicates that Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate. Following Lipinski's Rule of Five, Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate?
The CAS number of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate is 256326-04-2.
What is the molecular formula of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate?
The molecular formula of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate is C18H15F6N3O3.
What is the molecular weight of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate?
The molecular weight of Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate is 435.10 g/mol.
Where can I buy Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate?
You can request a quote for Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3,3,3-trifluoro-2-nicotinamido-2-[2-(trifluoromethyl)anilino]propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.