![2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide structure](/static/products/3384/338405-73-5.webp)
2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide
TL;DR: 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide (CAS 338405-73-5) is a chemical compound with molecular formula C13H11N5S and molecular weight 269.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylsulfanyl]pyridine
Also Known As: 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide, 2-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylsulfanyl]pyridine, 4-{3-[(pyridin-2-ylsulfanyl)methyl]-1H-1,2,4-triazol-5-yl}pyridine, 4-{5-[(pyridin-2-ylsulfanyl)methyl]-4H-1,2,4-triazol-3-yl}pyridine
| Molecular Formula | C13H11N5S |
|---|---|
| Molecular Weight | 269.07 g/mol |
| LogP | 2.554 |
| Topological Polar Surface Area | 67.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.07352 |
| Heavy Atoms | 19 |
| Complexity | 638.40826 |
Chemical Identifiers
| CAS Number | 338405-73-5 |
|---|---|
| SMILES | C1=CC=NC(=C1)SCC2=NC(=NN2)C3=CC=NC=C3 |
Product Overview
2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide (CAS 338405-73-5), with molecular formula C13H11N5S and molecular weight 269.07 g/mol. IUPAC: 2-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylsulfanyl]pyridine.
Chemical Property Profile of 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide
Property Insights of 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide
The XLogP value of 2.554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide. The TPSA of 67.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide. Following Lipinski's Rule of Five, 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide has 1 hydrogen bond donor(s) and 5 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-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide?
The CAS number of 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide is 338405-73-5.
What is the molecular formula of 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide?
The molecular formula of 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide is C13H11N5S.
What is the molecular weight of 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide?
The molecular weight of 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide is 269.07 g/mol.
Where can I buy 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide?
You can request a quote for 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 2-pyridinyl [5-(4-pyridinyl)-1H-1,2,4-triazol-3-yl]methyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.