![3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole structure](/static/products/849/849035-13-8.png)
3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole
TL;DR: 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole (CAS 849035-13-8) is a chemical compound with molecular formula C20H16FN3OS and molecular weight 365.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-fluorophenyl)methylsulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazole
Also Known As: 3-[(3-fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole, 3-((3-fluorobenzyl)thio)-4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazole, 3-[(3-fluorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazole, 3-[(3-fluorophenyl)methylsulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazole, 3-{[(3-fluorophenyl)methyl]sulfanyl}-4-(furan-2-ylmethyl)-5-phenyl-4H-1,2,4-triazole
| Molecular Formula | C20H16FN3OS |
|---|---|
| Molecular Weight | 365.10 g/mol |
| LogP | 5.0178 |
| Topological Polar Surface Area | 43.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.09982 |
| Heavy Atoms | 26 |
| Complexity | 983.486 |
Chemical Identifiers
| CAS Number | 849035-13-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC(=CC=C4)F |
Product Overview
3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole (CAS 849035-13-8), with molecular formula C20H16FN3OS and molecular weight 365.10 g/mol. IUPAC: 3-[(3-fluorophenyl)methylsulfanyl]-4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazole.
Chemical Property Profile of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole
Property Insights of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole
The XLogP value of 5.0178 indicates that 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-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 43.85 Ų, 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole?
The CAS number of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole is 849035-13-8.
What is the molecular formula of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole?
The molecular formula of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole is C20H16FN3OS.
What is the molecular weight of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole?
The molecular weight of 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole is 365.10 g/mol.
Where can I buy 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole?
You can request a quote for 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-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-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-Fluorophenyl)methylthio]-4-(2-furylmethyl)-5-phenyl-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.