![2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester structure](/static/products/340/340029-77-8.png)
2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester
TL;DR: 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester (CAS 340029-77-8) is a chemical compound with molecular formula C17H15ClF3N3O4 and molecular weight 417.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5-chloro-2-pyridinyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxypropanoate
Also Known As: 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester, ethyl 2-({[(5-chloro-2-pyridinyl)amino]carbonyl}amino)-3,3,3-trifluoro-2-phenoxypropanoate, ethyl 2-(3-(5-chloropyridin-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate, ethyl 2-[(5-chloropyridin-2-yl)carbamoylamino]-3,3,3-trifluoro-2-phenoxypropanoate, ethyl N-[(5-chloropyridin-2-yl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate
| Molecular Formula | C17H15ClF3N3O4 |
|---|---|
| Molecular Weight | 417.07 g/mol |
| LogP | 3.7572 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.0703 |
| Heavy Atoms | 28 |
| Complexity | 818.64734 |
Chemical Identifiers
| CAS Number | 340029-77-8 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=NC=C(C=C1)Cl)OC2=CC=CC=C2 |
Product Overview
2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester (CAS 340029-77-8), with molecular formula C17H15ClF3N3O4 and molecular weight 417.07 g/mol. IUPAC: ethyl 2-[(5-chloro-2-pyridinyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxypropanoate.
Chemical Property Profile of 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester
Property Insights of 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester
The XLogP value of 3.7572 indicates that 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester. Following Lipinski's Rule of Five, 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester 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 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester?
The CAS number of 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester is 340029-77-8.
What is the molecular formula of 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester?
The molecular formula of 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester is C17H15ClF3N3O4.
What is the molecular weight of 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester?
The molecular weight of 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester is 417.07 g/mol.
Where can I buy 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester?
You can request a quote for 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(5-Chloro-pyridin-2-yl)-ureido]-3,3,3-trifluoro-2-phenoxy-propionic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.