![(E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one structure](/static/products/4778/477888-56-5.webp)
(E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one
TL;DR: (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one (CAS 477888-56-5) is a chemical compound with molecular formula C23H16ClF4NO3 and molecular weight 465.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-3-[4-(trifluoromethoxy)anilino]prop-2-en-1-one
Also Known As: (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one, 1-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-3-[4-(trifluoromethoxy)anilino]prop-2-en-1-one
| Molecular Formula | C23H16ClF4NO3 |
|---|---|
| Molecular Weight | 465.08 g/mol |
| LogP | 6.7652 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.07547 |
| Heavy Atoms | 32 |
| Complexity | 1077.4695 |
Chemical Identifiers
| CAS Number | 477888-56-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)COC2=CC=C(C=C2)C(=O)C=CNC3=CC=C(C=C3)OC(F)(F)F)F |
Product Overview
(E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one (CAS 477888-56-5), with molecular formula C23H16ClF4NO3 and molecular weight 465.08 g/mol. IUPAC: 1-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-3-[4-(trifluoromethoxy)anilino]prop-2-en-1-one.
Chemical Property Profile of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one
Property Insights of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one
The XLogP value of 6.7652 indicates that (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one?
The CAS number of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one is 477888-56-5.
What is the molecular formula of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one?
The molecular formula of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one is C23H16ClF4NO3.
What is the molecular weight of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one?
The molecular weight of (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one is 465.08 g/mol.
Where can I buy (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one?
You can request a quote for (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-3-[4-(trifluoromethoxy)anilino]-2-propen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.