6J-566S
TL;DR: 6J-566S (CAS 338964-65-1) is a chemical compound with molecular formula C20H10F6N2O and molecular weight 408.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(trifluoromethyl)phenoxy]-5-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
Also Known As: 6J-566S, 2-[3-(trifluoromethyl)phenoxy]-5-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile, 2-[3-(trifluoromethyl)phenoxy]-5-[3-(trifluoromethyl)phenyl]nicotinonitrile
| Molecular Formula | C20H10F6N2O |
|---|---|
| Molecular Weight | 408.07 g/mol |
| LogP | 6.45018 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.06973 |
| Heavy Atoms | 29 |
| Complexity | 1083.3052 |
Chemical Identifiers
| CAS Number | 338964-65-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C2=CC(=C(N=C2)OC3=CC=CC(=C3)C(F)(F)F)C#N |
Product Overview
6J-566S (CAS 338964-65-1), with molecular formula C20H10F6N2O and molecular weight 408.07 g/mol. IUPAC: 2-[3-(trifluoromethyl)phenoxy]-5-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile.
Chemical Property Profile of 6J-566S
Property Insights of 6J-566S
The XLogP value of 6.45018 indicates that 6J-566S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 6J-566S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6J-566S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6J-566S?
The CAS number of 6J-566S is 338964-65-1.
What is the molecular formula of 6J-566S?
The molecular formula of 6J-566S is C20H10F6N2O.
What is the molecular weight of 6J-566S?
The molecular weight of 6J-566S is 408.07 g/mol.
Where can I buy 6J-566S?
You can request a quote for 6J-566S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6J-566S?
Yes, KEHONG BIO provides custom synthesis services for 6J-566S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.