![2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine structure](/static/products/263/263157-78-4.png)
2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine
TL;DR: 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine (CAS 263157-78-4) is a chemical compound with molecular formula C8H7N5O2S and molecular weight 237.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine
Also Known As: Cyto11D6, Maybridge1_008518, BAS 04848849, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine, 2-(4-methyl(1,2,4-triazol-3-ylthio))-5-nitropyridine
| Molecular Formula | C8H7N5O2S |
|---|---|
| Molecular Weight | 237.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.03204 |
| Heavy Atoms | 16 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 263157-78-4 |
|---|---|
| SMILES | CN1C=NN=C1SC2=NC=C(C=C2)[N+](=O)[O-] |
| InChIKey | OGUHHONZCODPHH-UHFFFAOYSA-N |
Product Overview
2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine (CAS 263157-78-4), with molecular formula C8H7N5O2S and molecular weight 237.03 g/mol. IUPAC: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine.
Chemical Property Profile of 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine
Property Insights of 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine. Following Lipinski's Rule of Five, 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine has 0 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 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
The CAS number of 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine is 263157-78-4.
What is the molecular formula of 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
The molecular formula of 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine is C8H7N5O2S.
What is the molecular weight of 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
The molecular weight of 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine is 237.03 g/mol.
Where can I buy 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
You can request a quote for 2-[(4-methyl-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-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitropyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.