4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole
TL;DR: 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole (CAS 577790-47-7) is a chemical compound with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-(furan-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole
Also Known As: 4-ethyl-3-(2-furyl)-5-[(4-methoxybenzyl)sulfanyl]-4H-1,2,4-triazole, 4-ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4h-1,2,4-triazole, 4-ethyl-3-(2-furyl)-5-[(4-methoxybenzyl)thio]-4H-1,2,4-triazole, 4-Ethyl-3-(furan-2-yl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole, 4-ethyl-3-(furan-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole
| Molecular Formula | C16H17N3O2S |
|---|---|
| Molecular Weight | 315.10 g/mol |
| LogP | 3.8589 |
| Topological Polar Surface Area | 53.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.10416 |
| Heavy Atoms | 22 |
| Complexity | 720.4462 |
Chemical Identifiers
| CAS Number | 577790-47-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC2=CC=C(C=C2)OC)C3=CC=CO3 |
Product Overview
4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole (CAS 577790-47-7), with molecular formula C16H17N3O2S and molecular weight 315.10 g/mol. IUPAC: 4-ethyl-3-(furan-2-yl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole.
Chemical Property Profile of 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole
Property Insights of 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole
The XLogP value of 3.8589 indicates that 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-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, 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-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 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole?
The CAS number of 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole is 577790-47-7.
What is the molecular formula of 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole?
The molecular formula of 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole is C16H17N3O2S.
What is the molecular weight of 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole?
The molecular weight of 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole is 315.10 g/mol.
Where can I buy 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole?
You can request a quote for 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-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 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethyl-3-(2-furyl)-5-((4-methoxybenzyl)thio)-4H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.