3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole
TL;DR: 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole (CAS 677295-15-7) is a chemical compound with molecular formula C15H15N3O2S and molecular weight 301.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-1,2,4-triazole
Also Known As: BUTTPARK 101\41-21, 3-(2-FURYL)-5-((4-METHOXYBENZYL)THIO)-4-METHYL-4H-1,2,4-TRIAZOLE, 3-(Furan-2-yl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole, 3-(furan-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-1,2,4-triazole, 3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
| Molecular Formula | C15H15N3O2S |
|---|---|
| Molecular Weight | 301.09 g/mol |
| LogP | 3.376 |
| Topological Polar Surface Area | 53.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.0885 |
| Heavy Atoms | 21 |
| Complexity | 705.11127 |
Chemical Identifiers
| CAS Number | 677295-15-7 |
|---|---|
| SMILES | CN1C(=NN=C1SCC2=CC=C(C=C2)OC)C3=CC=CO3 |
Product Overview
3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole (CAS 677295-15-7), with molecular formula C15H15N3O2S and molecular weight 301.09 g/mol. IUPAC: 3-(furan-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-4-methyl-1,2,4-triazole.
Chemical Property Profile of 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole
Property Insights of 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole
The XLogP value of 3.376 indicates that 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.08 Ų, 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole has 0 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 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole?
The CAS number of 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole is 677295-15-7.
What is the molecular formula of 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole?
The molecular formula of 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole is C15H15N3O2S.
What is the molecular weight of 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole?
The molecular weight of 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole is 301.09 g/mol.
Where can I buy 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole?
You can request a quote for 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-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 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Furyl)-5-((4-methoxybenzyl)thio)-4-methyl-4H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.