![ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate structure](/static/products/340/340029-76-7.png)
ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate
TL;DR: ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate (CAS 340029-76-7) is a chemical compound with molecular formula C19H18ClF3N2O5 and molecular weight 446.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5-chloro-2-methoxyphenyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxypropanoate
Also Known As: ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate, ethyl 2-(3-(5-chloro-2-methoxyphenyl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate, Ethyl 2-[(5-chloro-2-methoxy-phenyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxy-propanoate, ethyl 2-[(5-chloro-2-methoxyphenyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxypropanoate
| Molecular Formula | C19H18ClF3N2O5 |
|---|---|
| Molecular Weight | 446.09 g/mol |
| LogP | 4.3708 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.08563 |
| Heavy Atoms | 30 |
| Complexity | 895.48376 |
Chemical Identifiers
| CAS Number | 340029-76-7 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=C(C=CC(=C1)Cl)OC)OC2=CC=CC=C2 |
Product Overview
ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate (CAS 340029-76-7), with molecular formula C19H18ClF3N2O5 and molecular weight 446.09 g/mol. IUPAC: ethyl 2-[(5-chloro-2-methoxyphenyl)carbamoylamino]-3,3,3-trifluoro-2-phenoxypropanoate.
Chemical Property Profile of ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate
Property Insights of ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate
The XLogP value of 4.3708 indicates that ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate. Following Lipinski's Rule of Five, ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate 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 N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate?
The CAS number of ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate is 340029-76-7.
What is the molecular formula of ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate?
The molecular formula of ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate is C19H18ClF3N2O5.
What is the molecular weight of ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate?
The molecular weight of ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate is 446.09 g/mol.
Where can I buy ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate?
You can request a quote for ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[(5-chloro-2-methoxyphenyl)carbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.