![5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole structure](/static/products/5855/585560-31-2.webp)
5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole
TL;DR: 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole (CAS 585560-31-2) is a chemical compound with molecular formula C15H15N3OS and molecular weight 285.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-yl)-4-methyl-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole
Also Known As: 5-(2-furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole, 3-(furan-2-yl)-4-methyl-5-((3-methylbenzyl)thio)-4H-1,2,4-triazole, 3-(furan-2-yl)-4-methyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole, 3-(furan-2-yl)-4-methyl-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole, 3-(furan-2-yl)-4-methyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
| Molecular Formula | C15H15N3OS |
|---|---|
| Molecular Weight | 285.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.0936 |
| Heavy Atoms | 20 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 585560-31-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CSC2=NN=C(N2C)C3=CC=CO3 |
| InChIKey | MDJZCJHYYXYMIX-UHFFFAOYSA-N |
Product Overview
5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole (CAS 585560-31-2), with molecular formula C15H15N3OS and molecular weight 285.09 g/mol. IUPAC: 3-(furan-2-yl)-4-methyl-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazole.
Chemical Property Profile of 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole
Property Insights of 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole. Following Lipinski's Rule of Five, 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole 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 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole?
The CAS number of 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole is 585560-31-2.
What is the molecular formula of 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole?
The molecular formula of 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole is C15H15N3OS.
What is the molecular weight of 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole?
The molecular weight of 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole is 285.09 g/mol.
Where can I buy 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole?
You can request a quote for 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Furyl)-4-methyl-3-[(3-methylphenyl)methylthio]-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.