RefChem:318757
TL;DR: RefChem:318757 (CAS 1868-72-0) is a chemical compound with molecular formula C19H23F3INO and molecular weight 465.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-[phenyl-[3-(trifluoromethyl)phenyl]methoxy]ethyl]azanium iodide
Also Known As: (2-(alpha-(alpha,alpha,alpha-Trifluoro-m-tolyl)benzyloxy)ethyl)trimethylammonium iodide, Ammonium, (2-(alpha-(alpha,alpha,alpha-trifluoro-m-tolyl)benzyloxy)ethyl)trimethyl-, iodide, Ammonium, trimethyl(2-((alpha-phenyl-m-(trifluoromethyl)benzyl)oxy)ethyl)-, iodide, Ammonium, trimethyl[2-[[.alpha.-phenyl-m-(trifluoromethyl)benzyl]oxy]ethyl]-, iodide, N,N,N-Trimethyl-2-{phenyl[3-(trifluoromethyl)phenyl]methoxy}ethan-1-aminium iodide
| Molecular Formula | C19H23F3INO |
|---|---|
| Molecular Weight | 465.08 g/mol |
| LogP | 1.52 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.07764 |
| Heavy Atoms | 25 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 1868-72-0 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(C1=CC=CC=C1)C2=CC(=CC=C2)C(F)(F)F.[I-] |
| InChIKey | BMNFSSZOYTXTOZ-UHFFFAOYSA-M |
Product Overview
RefChem:318757 (CAS 1868-72-0), with molecular formula C19H23F3INO and molecular weight 465.08 g/mol. IUPAC: trimethyl-[2-[phenyl-[3-(trifluoromethyl)phenyl]methoxy]ethyl]azanium iodide.
Chemical Property Profile of RefChem:318757
Property Insights of RefChem:318757
The XLogP value of 1.52 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:318757. With a topological polar surface area (TPSA) of 9.2 Ų, RefChem:318757 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318757 has 0 hydrogen bond donor(s) and 5 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 RefChem:318757?
The CAS number of RefChem:318757 is 1868-72-0.
What is the molecular formula of RefChem:318757?
The molecular formula of RefChem:318757 is C19H23F3INO.
What is the molecular weight of RefChem:318757?
The molecular weight of RefChem:318757 is 465.08 g/mol.
Where can I buy RefChem:318757?
You can request a quote for RefChem:318757 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318757?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318757 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.