WR 225448
TL;DR: WR 225448 (CAS 80065-55-0) is a chemical compound with molecular formula C23H26F3N3O2 and molecular weight 433.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]pentane-1,4-diamine
Also Known As: WR 225448, 8-((4-Amino-1-methylbutyl)amino)-6-methoxy-4-methyl-5-(3-trifluoromethylphenoxy)quinoline, 1,4-Pentanediamine, N4-(6-methoxy-4-methyl-5-(3-(trifluoromethyl)phenoxy)-8-quinolinyl)-, 4-N-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]pentane-1,4-diamine, 4-[4-Methyl-5-[3-(trifluoromethyl)phenoxy]-6-methoxy-8-quinolinylamino]pentane-1-amine
| Molecular Formula | C23H26F3N3O2 |
|---|---|
| Molecular Weight | 433.20 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 433.19772 |
| Heavy Atoms | 31 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 80065-55-0 |
|---|---|
| SMILES | CC1=C2C(=C(C=C(C2=NC=C1)NC(C)CCCN)OC)OC3=CC=CC(=C3)C(F)(F)F |
| InChIKey | NFJRZYIWFZYFNU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
WR 225448 (CAS 80065-55-0), with molecular formula C23H26F3N3O2 and molecular weight 433.20 g/mol. IUPAC: 4-N-[6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-yl]pentane-1,4-diamine.
Chemical Property Profile of WR 225448
Property Insights of WR 225448
The XLogP value of 5.1 indicates that WR 225448 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for WR 225448. Following Lipinski's Rule of Five, WR 225448 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of WR 225448?
The CAS number of WR 225448 is 80065-55-0.
What is the molecular formula of WR 225448?
The molecular formula of WR 225448 is C23H26F3N3O2.
What is the molecular weight of WR 225448?
The molecular weight of WR 225448 is 433.20 g/mol.
Where can I buy WR 225448?
You can request a quote for WR 225448 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WR 225448?
Yes, KEHONG BIO provides custom synthesis services for WR 225448 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.