![ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate structure](/static/products/372/372155-20-9.png)
ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate
TL;DR: ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate (CAS 372155-20-9) is a chemical compound with molecular formula C16H21F3N2O4 and molecular weight 362.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-[(2-methoxyphenyl)methylamino]-2-(propanoylamino)propanoate
Also Known As: ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate, (S)-ethyl 3,3,3-trifluoro-2-((2-methoxybenzyl)amino)-2-propionamidopropanoate, 3,3,3-Trifluoro-2-(2-methoxy-benzylamino)-2-propionylamino-propionic acid ethyl ester, ethyl 3,3,3-trifluoro-2-[(2-methoxyphenyl)methylamino]-2-(propanoylamino)propanoate, ETHYL 3,3,3-TRIFLUORO-2-{[(2-METHOXYPHENYL)METHYL]AMINO}-2-PROPANAMIDOPROPANOATE
| Molecular Formula | C16H21F3N2O4 |
|---|---|
| Molecular Weight | 362.15 g/mol |
| LogP | 2.1327 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 362.14536 |
| Heavy Atoms | 25 |
| Complexity | 607.2878 |
Chemical Identifiers
| CAS Number | 372155-20-9 |
|---|---|
| SMILES | CCC(=O)NC(C(=O)OCC)(C(F)(F)F)NCC1=CC=CC=C1OC |
Product Overview
ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate (CAS 372155-20-9), with molecular formula C16H21F3N2O4 and molecular weight 362.15 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-[(2-methoxyphenyl)methylamino]-2-(propanoylamino)propanoate.
Chemical Property Profile of ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate
Property Insights of ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate
The XLogP value of 2.1327 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate. Following Lipinski's Rule of Five, ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate 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 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate?
The CAS number of ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate is 372155-20-9.
What is the molecular formula of ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate?
The molecular formula of ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate is C16H21F3N2O4.
What is the molecular weight of ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate?
The molecular weight of ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate is 362.15 g/mol.
Where can I buy ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate?
You can request a quote for ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate 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-[(2-methoxybenzyl)amino]-N-propanoylalaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3,3,3-trifluoro-2-[(2-methoxybenzyl)amino]-N-propanoylalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.