3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one
TL;DR: 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one (CAS 448939-17-1) is a chemical compound with molecular formula C24H16ClF3O3 and molecular weight 444.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-7-[(4-methylphenyl)methoxy]-2-(trifluoromethyl)chromen-4-one
Also Known As: 3-(4-chlorophenyl)-7-[(4-methylphenyl)methoxy]-2-(trifluoromethyl)chromen-4-one, 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one, 3-(4-chlorophenyl)-7-[(4-methylbenzyl)oxy]-2-(trifluoromethyl)-4H-chromen-4-one, 3-(4-chlorophenyl)-7-[(4-methylphenyl)methoxy]-2-(trifluoromethyl)chromen-4-on e
| Molecular Formula | C24H16ClF3O3 |
|---|---|
| Molecular Weight | 444.07 g/mol |
| LogP | 7.01962 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.074 |
| Heavy Atoms | 31 |
| Complexity | 1291.4431 |
Chemical Identifiers
| CAS Number | 448939-17-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=C(C=C4)Cl |
Product Overview
3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one (CAS 448939-17-1), with molecular formula C24H16ClF3O3 and molecular weight 444.07 g/mol. IUPAC: 3-(4-chlorophenyl)-7-[(4-methylphenyl)methoxy]-2-(trifluoromethyl)chromen-4-one.
Chemical Property Profile of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one
Property Insights of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one
The XLogP value of 7.01962 indicates that 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.44 Ų, 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one?
The CAS number of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one is 448939-17-1.
What is the molecular formula of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one?
The molecular formula of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one is C24H16ClF3O3.
What is the molecular weight of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one?
The molecular weight of 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one is 444.07 g/mol.
Where can I buy 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one?
You can request a quote for 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-chlorophenyl)-7-((4-methylbenzyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.