![2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine structure](/static/products/7913/79134-15-9.webp)
2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine
TL;DR: 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine (CAS 79134-15-9) is a chemical compound with molecular formula C7H6N6O2S and molecular weight 238.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5-nitro-2-pyridinyl)sulfanyl]-1H-1,2,4-triazol-5-amine
Also Known As: 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine, AI-204/31688050, 3-(5-nitropyridin-2-yl)sulfanyl-1H-1,2,4-triazol-5-amine, 5-(5-Nitropyridin-2-ylsulfanyl)-4H-[1,2,4]triazol-3-ylamine
| Molecular Formula | C7H6N6O2S |
|---|---|
| Molecular Weight | 238.03 g/mol |
| LogP | 0.8413 |
| Topological Polar Surface Area | 123.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0273 |
| Heavy Atoms | 16 |
| Complexity | 509.85052 |
Chemical Identifiers
| CAS Number | 79134-15-9 |
|---|---|
| SMILES | C1=CC(=NC=C1[N+](=O)[O-])SC2=NNC(=N2)N |
Product Overview
2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine (CAS 79134-15-9), with molecular formula C7H6N6O2S and molecular weight 238.03 g/mol. IUPAC: 3-[(5-nitro-2-pyridinyl)sulfanyl]-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine
Property Insights of 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine
The XLogP value of 0.8413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine. The TPSA of 123.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine. Following Lipinski's Rule of Five, 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine has 2 hydrogen bond donor(s) and 7 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-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
The CAS number of 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine is 79134-15-9.
What is the molecular formula of 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
The molecular formula of 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine is C7H6N6O2S.
What is the molecular weight of 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
The molecular weight of 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine is 238.03 g/mol.
Where can I buy 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
You can request a quote for 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.