4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine
TL;DR: 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 57296-03-4) is a chemical compound with molecular formula C9H10N4S and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine
Also Known As: 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine, 8419AB, 8420AB, BAS 02054492, bis(2,5-dioxopyrrolidin-1-yl) oxalate
| Molecular Formula | C9H10N4S |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 1.599 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.06262 |
| Heavy Atoms | 14 |
| Complexity | 423.63193 |
Chemical Identifiers
| CAS Number | 57296-03-4 |
|---|---|
| SMILES | CN1C(=NN=C1SC)C2=CC=NC=C2 |
Product Overview
4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 57296-03-4), with molecular formula C9H10N4S and molecular weight 206.06 g/mol. IUPAC: 4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyridine.
Chemical Property Profile of 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine
Property Insights of 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine
The XLogP value of 1.599 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine. With a topological polar surface area (TPSA) of 43.6 Ų, 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine 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 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine?
The CAS number of 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine is 57296-03-4.
What is the molecular formula of 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine?
The molecular formula of 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine is C9H10N4S.
What is the molecular weight of 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine?
The molecular weight of 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine is 206.06 g/mol.
Where can I buy 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine?
You can request a quote for 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methyl-5-(methylthio)-4H-1,2,4-triazol-3-yl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.