2-Picoline, 5-(tert-butylthio)-
TL;DR: 2-Picoline, 5-(tert-butylthio)- (CAS 18794-44-0) is a chemical compound with molecular formula C10H15NS and molecular weight 181.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butylsulfanyl-2-methylpyridine
Also Known As: 2-Picoline, 5-(tert-butylthio)-, 5-tert-butylsulfanyl-2-methylpyridine, 5-(tert-Butylthio)-2-methylpyridine, 5-(tert-Butylthio)-2-picoline, 5-tert-Butylthio-2-methylpyridine
| Molecular Formula | C10H15NS |
|---|---|
| Molecular Weight | 181.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.09251 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 18794-44-0 |
|---|---|
| SMILES | CC1=NC=C(C=C1)SC(C)(C)C |
| InChIKey | JKXJDOBWRNBBMA-UHFFFAOYSA-N |
Product Overview
2-Picoline, 5-(tert-butylthio)- (CAS 18794-44-0), with molecular formula C10H15NS and molecular weight 181.09 g/mol. IUPAC: 5-tert-butylsulfanyl-2-methylpyridine.
Chemical Property Profile of 2-Picoline, 5-(tert-butylthio)-
Property Insights of 2-Picoline, 5-(tert-butylthio)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Picoline, 5-(tert-butylthio)-. With a topological polar surface area (TPSA) of 38.2 Ų, 2-Picoline, 5-(tert-butylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Picoline, 5-(tert-butylthio)- 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-Picoline, 5-(tert-butylthio)-?
The CAS number of 2-Picoline, 5-(tert-butylthio)- is 18794-44-0.
What is the molecular formula of 2-Picoline, 5-(tert-butylthio)-?
The molecular formula of 2-Picoline, 5-(tert-butylthio)- is C10H15NS.
What is the molecular weight of 2-Picoline, 5-(tert-butylthio)-?
The molecular weight of 2-Picoline, 5-(tert-butylthio)- is 181.09 g/mol.
Where can I buy 2-Picoline, 5-(tert-butylthio)-?
You can request a quote for 2-Picoline, 5-(tert-butylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Picoline, 5-(tert-butylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Picoline, 5-(tert-butylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.