4E-924
TL;DR: 4E-924 (CAS 338418-40-9) is a chemical compound with molecular formula C28H20F6O5 and molecular weight 550.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-oxo-2-[[3-(trifluoromethyl)benzoyl]oxymethyl]-3,4-dihydronaphthalen-2-yl]methyl 3-(trifluoromethyl)benzoate
Also Known As: 4E-924, [1-oxo-2-({[3-(trifluoromethyl)benzoyl]oxy}methyl)-1,2,3,4-tetrahydro-2-naphthalenyl]methyl 3-(trifluoromethyl)benzenecarboxylate, [1-oxo-2-[[3-(trifluoromethyl)benzoyl]oxymethyl]-3,4-dihydronaphthalen-2-yl]methyl 3-(trifluoromethyl)benzoate, (1-oxo-2-{[3-(trifluoromethyl)benzoyloxy]methyl}-1,2,3,4-tetrahydronaphthalen-2-yl)methyl 3-(trifluoromethyl)benzoate, (1-oxo-2-{[3-(trifluoromethyl)benzoyloxy]methyl}-1,2,3,4-tetrahydronaphthalen-2-yl)methyl3-(trifluoromethyl)benzoate
| Molecular Formula | C28H20F6O5 |
|---|---|
| Molecular Weight | 550.12 g/mol |
| LogP | 6.5535 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 550.1215 |
| Heavy Atoms | 39 |
| Complexity | 1336.2928 |
Chemical Identifiers
| CAS Number | 338418-40-9 |
|---|---|
| SMILES | C1CC(C(=O)C2=CC=CC=C21)(COC(=O)C3=CC(=CC=C3)C(F)(F)F)COC(=O)C4=CC(=CC=C4)C(F)(F)F |
Product Overview
4E-924 (CAS 338418-40-9), with molecular formula C28H20F6O5 and molecular weight 550.12 g/mol. IUPAC: [1-oxo-2-[[3-(trifluoromethyl)benzoyl]oxymethyl]-3,4-dihydronaphthalen-2-yl]methyl 3-(trifluoromethyl)benzoate.
Chemical Property Profile of 4E-924
Property Insights of 4E-924
The XLogP value of 6.5535 indicates that 4E-924 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4E-924. Following Lipinski's Rule of Five, 4E-924 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4E-924?
The CAS number of 4E-924 is 338418-40-9.
What is the molecular formula of 4E-924?
The molecular formula of 4E-924 is C28H20F6O5.
What is the molecular weight of 4E-924?
The molecular weight of 4E-924 is 550.12 g/mol.
Where can I buy 4E-924?
You can request a quote for 4E-924 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4E-924?
Yes, KEHONG BIO provides custom synthesis services for 4E-924 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.