![ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate structure](/static/products/3384/338406-77-2.webp)
ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate
TL;DR: ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate (CAS 338406-77-2) is a chemical compound with molecular formula C13H14ClF3N2O3 and molecular weight 338.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate
Also Known As: ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate, ethyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(dimethylcarbamoyl)acetate, ethyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-3-(dimethylamino)-3-oxopropanoate, ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-3-(dimethylamino)-3-oxo-propanoate, ethyl2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(dimethylcarbamoyl)acetate
| Molecular Formula | C13H14ClF3N2O3 |
|---|---|
| Molecular Weight | 338.06 g/mol |
| LogP | 2.4887 |
| Topological Polar Surface Area | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.0645 |
| Heavy Atoms | 22 |
| Complexity | 576.13904 |
Chemical Identifiers
| CAS Number | 338406-77-2 |
|---|---|
| SMILES | CCOC(=O)C(C1=C(C=C(C=N1)C(F)(F)F)Cl)C(=O)N(C)C |
Product Overview
ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate (CAS 338406-77-2), with molecular formula C13H14ClF3N2O3 and molecular weight 338.06 g/mol. IUPAC: ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate.
Chemical Property Profile of ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate
Property Insights of ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate
The XLogP value of 2.4887 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate. With a topological polar surface area (TPSA) of 59.5 Ų, ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate has 0 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 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate?
The CAS number of ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate is 338406-77-2.
What is the molecular formula of ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate?
The molecular formula of ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate is C13H14ClF3N2O3.
What is the molecular weight of ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate?
The molecular weight of ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate is 338.06 g/mol.
Where can I buy ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate?
You can request a quote for ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate 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-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(dimethylamino)-3-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.