2,6-dimethyl-1H-pyridine-4-thione
TL;DR: 2,6-dimethyl-1H-pyridine-4-thione (CAS 98547-78-5) is a chemical compound with molecular formula C7H9NS and molecular weight 139.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyl-1H-pyridine-4-thione
Also Known As: 2,6-dimethyl-1H-pyridine-4-thione, 2,6-Dimethylpyridine-4-thiol, 2,6-Dimethyl-pyridin-4-thiol, 2,6-dimethylpyridine-4(1H)-thione, 4(1H)-Pyridinethione, 2,6-dimethyl-
| Molecular Formula | C7H9NS |
|---|---|
| Molecular Weight | 139.05 g/mol |
| LogP | 2.36103 |
| Topological Polar Surface Area | 15.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 139.04558 |
| Heavy Atoms | 9 |
| Complexity | 238.61382 |
Chemical Identifiers
| CAS Number | 98547-78-5 |
|---|---|
| SMILES | CC1=CC(=S)C=C(N1)C |
Product Overview
2,6-dimethyl-1H-pyridine-4-thione (CAS 98547-78-5), with molecular formula C7H9NS and molecular weight 139.05 g/mol. IUPAC: 2,6-dimethyl-1H-pyridine-4-thione.
Chemical Property Profile of 2,6-dimethyl-1H-pyridine-4-thione
Property Insights of 2,6-dimethyl-1H-pyridine-4-thione
The XLogP value of 2.36103 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-dimethyl-1H-pyridine-4-thione. With a topological polar surface area (TPSA) of 15.79 Ų, 2,6-dimethyl-1H-pyridine-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-dimethyl-1H-pyridine-4-thione has 1 hydrogen bond donor(s) and 1 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 2,6-dimethyl-1H-pyridine-4-thione?
The CAS number of 2,6-dimethyl-1H-pyridine-4-thione is 98547-78-5.
What is the molecular formula of 2,6-dimethyl-1H-pyridine-4-thione?
The molecular formula of 2,6-dimethyl-1H-pyridine-4-thione is C7H9NS.
What is the molecular weight of 2,6-dimethyl-1H-pyridine-4-thione?
The molecular weight of 2,6-dimethyl-1H-pyridine-4-thione is 139.05 g/mol.
Where can I buy 2,6-dimethyl-1H-pyridine-4-thione?
You can request a quote for 2,6-dimethyl-1H-pyridine-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-dimethyl-1H-pyridine-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 2,6-dimethyl-1H-pyridine-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.