![8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one structure](/static/products/6858/685861-19-2.webp)
8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one
TL;DR: 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one (CAS 685861-19-2) is a chemical compound with molecular formula C28H34F3NO4 and molecular weight 505.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[[bis(2-methylpropyl)amino]methyl]-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)chromen-4-one
Also Known As: 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one, 8-[[bis(2-methylpropyl)amino]methyl]-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)chromen-4-one, 8-{[BIS(2-METHYLPROPYL)AMINO]METHYL}-7-HYDROXY-3-(4-PROPYLPHENOXY)-2-(TRIFLUOROMETHYL)CHROMEN-4-ONE, 8-[(diisobutylamino)methyl]-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)chromen-4-one, 8-((Diisobutylamino)methyl)-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one
| Molecular Formula | C28H34F3NO4 |
|---|---|
| Molecular Weight | 505.24 g/mol |
| LogP | 7.3762 |
| Topological Polar Surface Area | 62.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 505.244 |
| Heavy Atoms | 36 |
| Complexity | 1220.749 |
Chemical Identifiers
| CAS Number | 685861-19-2 |
|---|---|
| SMILES | CCCC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN(CC(C)C)CC(C)C)O)C(F)(F)F |
Product Overview
8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one (CAS 685861-19-2), with molecular formula C28H34F3NO4 and molecular weight 505.24 g/mol. IUPAC: 8-[[bis(2-methylpropyl)amino]methyl]-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)chromen-4-one.
Chemical Property Profile of 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one
Property Insights of 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one
The XLogP value of 7.3762 indicates that 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one. Following Lipinski's Rule of Five, 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one has 1 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 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one?
The CAS number of 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one is 685861-19-2.
What is the molecular formula of 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one?
The molecular formula of 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one is C28H34F3NO4.
What is the molecular weight of 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one?
The molecular weight of 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one is 505.24 g/mol.
Where can I buy 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one?
You can request a quote for 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-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 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 8-{[bis(2-methylpropyl)amino]methyl}-7-hydroxy-3-(4-propylphenoxy)-2-(trifluoromethyl)-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.