3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole
TL;DR: 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole (CAS 848999-38-2) is a chemical compound with molecular formula C20H15F2N3OS and molecular weight 383.0904 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-fluorophenyl)-5-[(2-fluorophenyl)methylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole
Also Known As: 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole, 3-(2-fluorophenyl)-5-[(2-fluorophenyl)methylsulfanyl]-4-(furan-2-ylmethyl)-1,2,4-triazole, 3-[(2-fluorobenzyl)sulfanyl]-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole
Technical Specifications
| Molecular Formula | C20H15F2N3OS |
| Molecular Weight | 383.0904 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.0904 Da |
| Heavy Atoms | 27 |
| Complexity | 475.0 |
| SMILES | C1=CC=C(C(=C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4F)F |
| InChIKey | GLBPHWZOJCDJGX-UHFFFAOYSA-N |
Chemical Property Profile of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole
Property Insights of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole
The XLogP value of 4.3 indicates that 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole. Following Lipinski's Rule of Five, 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole 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
What is the CAS number of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole?
The CAS number of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole is 848999-38-2.
What is the molecular formula of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole?
The molecular formula of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole is C20H15F2N3OS.
What is the molecular weight of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole?
The molecular weight of 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole is 383.0904 g/mol.
Where can I buy 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole?
You can request a quote for 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole?
Yes, CoreyChem provides custom synthesis services for 3-((2-fluorobenzyl)thio)-5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.