2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine
TL;DR: 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine (CAS 204641-73-6) is a chemical compound with molecular formula C13H9ClF3NS and molecular weight 303.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-3-chloro-5-(trifluoromethyl)pyridine
Also Known As: 2-(Benzylthio)-3-chloro-5-(trifluoromethyl)pyridine, 2-benzylsulfanyl-3-chloro-5-(trifluoromethyl)pyridine, 2-(benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine
| Molecular Formula | C13H9ClF3NS |
|---|---|
| Molecular Weight | 303.01 g/mol |
| LogP | 5.0461 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.00964 |
| Heavy Atoms | 19 |
| Complexity | 557.55994 |
Chemical Identifiers
| CAS Number | 204641-73-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine (CAS 204641-73-6), with molecular formula C13H9ClF3NS and molecular weight 303.01 g/mol. IUPAC: 2-benzylsulfanyl-3-chloro-5-(trifluoromethyl)pyridine.
Chemical Property Profile of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine
Property Insights of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine
The XLogP value of 5.0461 indicates that 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine?
The CAS number of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine is 204641-73-6.
What is the molecular formula of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine?
The molecular formula of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine is C13H9ClF3NS.
What is the molecular weight of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine?
The molecular weight of 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine is 303.01 g/mol.
Where can I buy 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine?
You can request a quote for 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzylsulfanyl)-3-chloro-5-(trifluoromethyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.