Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane
TL;DR: Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane (CAS 327971-53-9) is a chemical compound with molecular formula C12H6F6N2S and molecular weight 324.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(trifluoromethyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]sulfanyl]pyridine
Also Known As: bis(5-(trifluoromethyl)pyridin-2-yl)sulfane, AB01317546-02, 5-(trifluoromethyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpyridine
| Molecular Formula | C12H6F6N2S |
|---|---|
| Molecular Weight | 324.02 g/mol |
| LogP | 4.6654 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.0156 |
| Heavy Atoms | 21 |
| Complexity | 548.1301 |
Chemical Identifiers
| CAS Number | 327971-53-9 |
|---|---|
| SMILES | C1=CC(=NC=C1C(F)(F)F)SC2=NC=C(C=C2)C(F)(F)F |
Product Overview
Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane (CAS 327971-53-9), with molecular formula C12H6F6N2S and molecular weight 324.02 g/mol. IUPAC: 5-(trifluoromethyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]sulfanyl]pyridine.
Chemical Property Profile of Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane
Property Insights of Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane
The XLogP value of 4.6654 indicates that Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane has 0 hydrogen bond donor(s) and 3 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 Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane?
The CAS number of Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane is 327971-53-9.
What is the molecular formula of Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane?
The molecular formula of Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane is C12H6F6N2S.
What is the molecular weight of Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane?
The molecular weight of Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane is 324.02 g/mol.
Where can I buy Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane?
You can request a quote for Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane?
Yes, KEHONG BIO provides custom synthesis services for Bis(5-(trifluoromethyl)pyridin-2-yl)sulfane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.