F0535-0706
TL;DR: F0535-0706 (CAS 486452-10-2) is a chemical compound with molecular formula C21H22F3NO4 and molecular weight 409.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone
Also Known As: F0535-0706, 1-(6,7-dimethoxy-1-((3-(trifluoromethyl)phenoxy)methyl)-3,4-dihydroisoquinolin-2(1H)-yl)ethanone, 1-(6,7-dimethoxy-1-{[3-(trifluoromethyl)phenoxy]methyl}-1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one, 1-[6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone
| Molecular Formula | C21H22F3NO4 |
|---|---|
| Molecular Weight | 409.15 g/mol |
| LogP | 4.2473 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.1501 |
| Heavy Atoms | 29 |
| Complexity | 897.98035 |
Chemical Identifiers
| CAS Number | 486452-10-2 |
|---|---|
| SMILES | CC(=O)N1CCC2=CC(=C(C=C2C1COC3=CC=CC(=C3)C(F)(F)F)OC)OC |
Product Overview
F0535-0706 (CAS 486452-10-2), with molecular formula C21H22F3NO4 and molecular weight 409.15 g/mol. IUPAC: 1-[6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]ethanone.
Chemical Property Profile of F0535-0706
Property Insights of F0535-0706
The XLogP value of 4.2473 indicates that F0535-0706 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, F0535-0706 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0535-0706 has 0 hydrogen bond donor(s) and 4 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 F0535-0706?
The CAS number of F0535-0706 is 486452-10-2.
What is the molecular formula of F0535-0706?
The molecular formula of F0535-0706 is C21H22F3NO4.
What is the molecular weight of F0535-0706?
The molecular weight of F0535-0706 is 409.15 g/mol.
Where can I buy F0535-0706?
You can request a quote for F0535-0706 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0535-0706?
Yes, KEHONG BIO provides custom synthesis services for F0535-0706 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.