2-(Hexylsulfanyl)pyridine
TL;DR: 2-(Hexylsulfanyl)pyridine (CAS 77326-92-2) is a chemical compound with molecular formula C11H17NS and molecular weight 195.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexylsulfanylpyridine
Also Known As: 2-(Hexylsulfanyl)pyridine, 2-hexylsulfanylpyridine, n-hexyl 2-pyridyl sulphide, Pyridine, 2-(hexylthio)-, Pyridine, 2-(hexylthio)- (9CI)
| Molecular Formula | C11H17NS |
|---|---|
| Molecular Weight | 195.11 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 195.10817 |
| Heavy Atoms | 13 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 77326-92-2 |
|---|---|
| SMILES | CCCCCCSC1=CC=CC=N1 |
| InChIKey | PBFOQFJGDSTHHT-UHFFFAOYSA-N |
Product Overview
2-(Hexylsulfanyl)pyridine (CAS 77326-92-2), with molecular formula C11H17NS and molecular weight 195.11 g/mol. IUPAC: 2-hexylsulfanylpyridine.
Chemical Property Profile of 2-(Hexylsulfanyl)pyridine
Property Insights of 2-(Hexylsulfanyl)pyridine
The XLogP value of 4.0 indicates that 2-(Hexylsulfanyl)pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.2 Ų, 2-(Hexylsulfanyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Hexylsulfanyl)pyridine has 0 hydrogen bond donor(s) and 2 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 2-(Hexylsulfanyl)pyridine?
The CAS number of 2-(Hexylsulfanyl)pyridine is 77326-92-2.
What is the molecular formula of 2-(Hexylsulfanyl)pyridine?
The molecular formula of 2-(Hexylsulfanyl)pyridine is C11H17NS.
What is the molecular weight of 2-(Hexylsulfanyl)pyridine?
The molecular weight of 2-(Hexylsulfanyl)pyridine is 195.11 g/mol.
Where can I buy 2-(Hexylsulfanyl)pyridine?
You can request a quote for 2-(Hexylsulfanyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Hexylsulfanyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Hexylsulfanyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.