Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate
TL;DR: Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate (CAS 327097-96-1) is a chemical compound with molecular formula C23H21F3N2O5 and molecular weight 462.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate
Also Known As: Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate, ethyl 3,3,3-trifluoro-2-hydroxy-2-(3-methoxy-4-(3-(naphthalen-2-yl)ureido)phenyl)propanoate, ethyl 3,3,3-trifluoro-2-hydroxy-2-{3-methoxy-4-[(N-(2-naphthyl)carbamoyl)amino ]phenyl}propanoate, ethyl 3,3,3-trifluoro-2-hydroxy-2-{3-methoxy-4-[(naphthalen-2-ylcarbamoyl)amino]phenyl}propanoate
| Molecular Formula | C23H21F3N2O5 |
|---|---|
| Molecular Weight | 462.14 g/mol |
| LogP | 4.8054 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.14026 |
| Heavy Atoms | 33 |
| Complexity | 1182.2158 |
Chemical Identifiers
| CAS Number | 327097-96-1 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC(=C(C=C1)NC(=O)NC2=CC3=CC=CC=C3C=C2)OC)(C(F)(F)F)O |
Product Overview
Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate (CAS 327097-96-1), with molecular formula C23H21F3N2O5 and molecular weight 462.14 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate.
Chemical Property Profile of Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate
Property Insights of Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate
The XLogP value of 4.8054 indicates that Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate. Following Lipinski's Rule of Five, Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate has 3 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-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate?
The CAS number of Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate is 327097-96-1.
What is the molecular formula of Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate?
The molecular formula of Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate is C23H21F3N2O5.
What is the molecular weight of Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate?
The molecular weight of Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate is 462.14 g/mol.
Where can I buy Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate?
You can request a quote for Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate 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-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.