F0535-0709
TL;DR: F0535-0709 (CAS 486452-12-4) is a chemical compound with molecular formula C22H23ClF3NO4 and molecular weight 457.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-[6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one
Also Known As: F0535-0709, 3-chloro-1-(6,7-dimethoxy-1-((3-(trifluoromethyl)phenoxy)methyl)-3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one, 3-chloro-1-(6,7-dimethoxy-1-{[3-(trifluoromethyl)phenoxy]methyl}-1,2,3,4-tetrahydroisoquinolin-2-yl)propan-1-one, 3-chloro-1-[6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one
| Molecular Formula | C22H23ClF3NO4 |
|---|---|
| Molecular Weight | 457.13 g/mol |
| LogP | 4.8563 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.12677 |
| Heavy Atoms | 31 |
| Complexity | 935.4574 |
Chemical Identifiers
| CAS Number | 486452-12-4 |
|---|---|
| SMILES | COC1=C(C=C2C(N(CCC2=C1)C(=O)CCCl)COC3=CC=CC(=C3)C(F)(F)F)OC |
Product Overview
F0535-0709 (CAS 486452-12-4), with molecular formula C22H23ClF3NO4 and molecular weight 457.13 g/mol. IUPAC: 3-chloro-1-[6,7-dimethoxy-1-[[3-(trifluoromethyl)phenoxy]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one.
Chemical Property Profile of F0535-0709
Property Insights of F0535-0709
The XLogP value of 4.8563 indicates that F0535-0709 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, F0535-0709 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0535-0709 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 F0535-0709?
The CAS number of F0535-0709 is 486452-12-4.
What is the molecular formula of F0535-0709?
The molecular formula of F0535-0709 is C22H23ClF3NO4.
What is the molecular weight of F0535-0709?
The molecular weight of F0535-0709 is 457.13 g/mol.
Where can I buy F0535-0709?
You can request a quote for F0535-0709 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0535-0709?
Yes, KEHONG BIO provides custom synthesis services for F0535-0709 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.