![ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate structure](/static/products/355/355155-84-9.png)
ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate
TL;DR: ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate (CAS 355155-84-9) is a chemical compound with molecular formula C13H14F3NO4 and molecular weight 305.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-hydroxy-2-[(4-methylbenzoyl)amino]propanoate
Also Known As: ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate, ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-methylbenzamido)propanoate, ethyl 3,3,3-trifluoro-2-hydroxy-2-[(4-methylbenzoyl)amino]propanoate
| Molecular Formula | C13H14F3NO4 |
|---|---|
| Molecular Weight | 305.09 g/mol |
| LogP | 1.53882 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.0875 |
| Heavy Atoms | 21 |
| Complexity | 527.2131 |
Chemical Identifiers
| CAS Number | 355155-84-9 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)C1=CC=C(C=C1)C)O |
Product Overview
ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate (CAS 355155-84-9), with molecular formula C13H14F3NO4 and molecular weight 305.09 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-hydroxy-2-[(4-methylbenzoyl)amino]propanoate.
Chemical Property Profile of ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate
Property Insights of ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate
The XLogP value of 1.53882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate. Following Lipinski's Rule of Five, ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate 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-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate?
The CAS number of ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate is 355155-84-9.
What is the molecular formula of ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate?
The molecular formula of ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate is C13H14F3NO4.
What is the molecular weight of ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate?
The molecular weight of ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate is 305.09 g/mol.
Where can I buy ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate?
You can request a quote for ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate 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-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3,3,3-trifluoro-2-hydroxy-N-[(4-methylphenyl)carbonyl]alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.