![ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate structure](/static/products/354/354773-05-0.png)
ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate
TL;DR: ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate (CAS 354773-05-0) is a chemical compound with molecular formula C13H14F4N2O4 and molecular weight 338.09 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-fluorophenyl)carbamoylamino]-2-methoxypropanoate
Also Known As: ethyl 3,3,3-trifluoro-2-(3-(4-fluorophenyl)ureido)-2-methoxypropanoate, ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate, ethyl 3,3,3-trifluoro-2-[(4-fluorophenyl)carbamoylamino]-2-methoxypropanoate
| Molecular Formula | C13H14F4N2O4 |
|---|---|
| Molecular Weight | 338.09 g/mol |
| LogP | 2.4153 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.08896 |
| Heavy Atoms | 23 |
| Complexity | 562.0881 |
Chemical Identifiers
| CAS Number | 354773-05-0 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=CC=C(C=C1)F)OC |
Product Overview
ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate (CAS 354773-05-0), with molecular formula C13H14F4N2O4 and molecular weight 338.09 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-[(4-fluorophenyl)carbamoylamino]-2-methoxypropanoate.
Chemical Property Profile of ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate
Property Insights of ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate
The XLogP value of 2.4153 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate. Following Lipinski's Rule of Five, ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate has 2 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-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate?
The CAS number of ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate is 354773-05-0.
What is the molecular formula of ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate?
The molecular formula of ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate is C13H14F4N2O4.
What is the molecular weight of ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate?
The molecular weight of ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate is 338.09 g/mol.
Where can I buy ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate?
You can request a quote for ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate 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-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3,3,3-trifluoro-N-[(4-fluorophenyl)carbamoyl]-2-methoxyalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.