Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate
TL;DR: Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate (CAS 355147-29-4) is a chemical compound with molecular formula C17H21F3N2O5 and molecular weight 390.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-ethyloxetan-3-yl)methoxy]-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate
Also Known As: ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate, ethyl 2-[(3-ethyloxetan-3-yl)methoxy]-3,3,3-trifluoro-N-(pyridin-3-ylcarbonyl)alaninate, ethyl 2-[(3-ethyloxetan-3-yl)methoxy]-3,3,3-trifluoro-2-(3-pyridylcarbonylamin o)propanoate, ethyl 2-[(3-ethyloxetan-3-yl)methoxy]-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate
| Molecular Formula | C17H21F3N2O5 |
|---|---|
| Molecular Weight | 390.14 g/mol |
| LogP | 2.0763 |
| Topological Polar Surface Area | 86.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 390.14026 |
| Heavy Atoms | 27 |
| Complexity | 658.773 |
Chemical Identifiers
| CAS Number | 355147-29-4 |
|---|---|
| SMILES | CCC1(COC1)COC(C(=O)OCC)(C(F)(F)F)NC(=O)C2=CN=CC=C2 |
Product Overview
Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate (CAS 355147-29-4), with molecular formula C17H21F3N2O5 and molecular weight 390.14 g/mol. IUPAC: ethyl 2-[(3-ethyloxetan-3-yl)methoxy]-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate.
Chemical Property Profile of Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate
Property Insights of Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate
The XLogP value of 2.0763 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate. The TPSA of 86.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate. Following Lipinski's Rule of Five, Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate has 1 hydrogen bond donor(s) and 6 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 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate?
The CAS number of Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate is 355147-29-4.
What is the molecular formula of Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate?
The molecular formula of Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate is C17H21F3N2O5.
What is the molecular weight of Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate?
The molecular weight of Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate is 390.14 g/mol.
Where can I buy Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate?
You can request a quote for Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-((3-ethyloxetan-3-yl)methoxy)-3,3,3-trifluoro-2-(nicotinamido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.