Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate
TL;DR: Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate (CAS 371214-40-3) is a chemical compound with molecular formula C13H13F4NO4 and molecular weight 323.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-[(4-fluorobenzoyl)amino]-2-methoxypropanoate
Also Known As: ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate, ethyl 3,3,3-trifluoro-2-[(4-fluorobenzoyl)amino]-2-methoxypropanoate, ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbonyl]-2-methoxyalaninate
| Molecular Formula | C13H13F4NO4 |
|---|---|
| Molecular Weight | 323.08 g/mol |
| LogP | 2.0236 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.07806 |
| Heavy Atoms | 22 |
| Complexity | 543.96625 |
Chemical Identifiers
| CAS Number | 371214-40-3 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)C1=CC=C(C=C1)F)OC |
Product Overview
Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate (CAS 371214-40-3), with molecular formula C13H13F4NO4 and molecular weight 323.08 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-[(4-fluorobenzoyl)amino]-2-methoxypropanoate.
Chemical Property Profile of Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate
Property Insights of Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate
The XLogP value of 2.0236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate. Following Lipinski's Rule of Five, Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate 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 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate?
The CAS number of Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate is 371214-40-3.
What is the molecular formula of Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate?
The molecular formula of Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate is C13H13F4NO4.
What is the molecular weight of Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate?
The molecular weight of Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate is 323.08 g/mol.
Where can I buy Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate?
You can request a quote for Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate 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-(4-fluorobenzamido)-2-methoxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3,3,3-trifluoro-2-(4-fluorobenzamido)-2-methoxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.