Pyridine, 2-(methylthio)-3-nitro-
TL;DR: Pyridine, 2-(methylthio)-3-nitro- (CAS 22746-79-8) is a chemical compound with molecular formula C6H6N2O2S and molecular weight 170.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-3-nitropyridine
Also Known As: 2-(methylthio)-3-nitropyridine, Pyridine, 2-(methylthio)-3-nitro-, 2-methylsulfanyl-3-nitropyridine, 2-Methylsulfanyl-3-nitro-pyridine, 2-methylthio-3-nitropyridine
| Molecular Formula | C6H6N2O2S |
|---|---|
| Molecular Weight | 170.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 84.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.015 |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 22746-79-8 |
|---|---|
| SMILES | CSC1=C(C=CC=N1)[N+](=O)[O-] |
| InChIKey | UGZSIPHNDAHATA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridine, 2-(methylthio)-3-nitro- (CAS 22746-79-8), with molecular formula C6H6N2O2S and molecular weight 170.01 g/mol. IUPAC: 2-methylsulfanyl-3-nitropyridine.
Chemical Property Profile of Pyridine, 2-(methylthio)-3-nitro-
Property Insights of Pyridine, 2-(methylthio)-3-nitro-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine, 2-(methylthio)-3-nitro-. The TPSA of 84.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridine, 2-(methylthio)-3-nitro-. Following Lipinski's Rule of Five, Pyridine, 2-(methylthio)-3-nitro- has 0 hydrogen bond donor(s) and 4 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 Pyridine, 2-(methylthio)-3-nitro-?
The CAS number of Pyridine, 2-(methylthio)-3-nitro- is 22746-79-8.
What is the molecular formula of Pyridine, 2-(methylthio)-3-nitro-?
The molecular formula of Pyridine, 2-(methylthio)-3-nitro- is C6H6N2O2S.
What is the molecular weight of Pyridine, 2-(methylthio)-3-nitro-?
The molecular weight of Pyridine, 2-(methylthio)-3-nitro- is 170.01 g/mol.
Where can I buy Pyridine, 2-(methylthio)-3-nitro-?
You can request a quote for Pyridine, 2-(methylthio)-3-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine, 2-(methylthio)-3-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Pyridine, 2-(methylthio)-3-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.