5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine
TL;DR: 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine (CAS 73768-81-7) is a chemical compound with molecular formula C7H5N5O2S and molecular weight 223.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine
Also Known As: 5-nitro-2-(4H-1,2,4-triazol-3-ylsulfanyl)pyridine, 5-nitro-2-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine, 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine, AJ-333/36116033, 3-[(5-Nitro-2-pyridyl)thio]-1H-1,2,4-triazole
| Molecular Formula | C7H5N5O2S |
|---|---|
| Molecular Weight | 223.02 g/mol |
| LogP | 1.2591 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.0164 |
| Heavy Atoms | 15 |
| Complexity | 454.7426 |
Chemical Identifiers
| CAS Number | 73768-81-7 |
|---|---|
| SMILES | C1=CC(=NC=C1[N+](=O)[O-])SC2=NC=NN2 |
Product Overview
5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine (CAS 73768-81-7), with molecular formula C7H5N5O2S and molecular weight 223.02 g/mol. IUPAC: 5-nitro-2-(1H-1,2,4-triazol-5-ylsulfanyl)pyridine.
Chemical Property Profile of 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine
Property Insights of 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine
The XLogP value of 1.2591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine. Following Lipinski's Rule of Five, 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine has 1 hydrogen bond donor(s) and 6 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 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine?
The CAS number of 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine is 73768-81-7.
What is the molecular formula of 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine?
The molecular formula of 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine is C7H5N5O2S.
What is the molecular weight of 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine?
The molecular weight of 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine is 223.02 g/mol.
Where can I buy 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine?
You can request a quote for 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-2-(1H-1,2,4-triazol-5-ylthio)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.