![3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole structure](/static/products/3117/311775-78-7.webp)
3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole
TL;DR: 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole (CAS 311775-78-7) is a chemical compound with molecular formula C19H13F2N3OS and molecular weight 369.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2,6-difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole
Also Known As: ChemDiv1_027278, 3-[(2,6-difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole, 3-[(2,6-difluorobenzyl)sulfanyl]-5-(2-furyl)-4-phenyl-4H-1,2,4-triazole, A1412/0063122, 3-((2,6-difluorobenzyl)thio)-5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazole
| Molecular Formula | C19H13F2N3OS |
|---|---|
| Molecular Weight | 369.07 g/mol |
| LogP | 5.0978 |
| Topological Polar Surface Area | 43.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.07474 |
| Heavy Atoms | 26 |
| Complexity | 996.46246 |
Chemical Identifiers
| CAS Number | 311775-78-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3F)F)C4=CC=CO4 |
Product Overview
3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole (CAS 311775-78-7), with molecular formula C19H13F2N3OS and molecular weight 369.07 g/mol. IUPAC: 3-[(2,6-difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole.
Chemical Property Profile of 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole
Property Insights of 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole
The XLogP value of 5.0978 indicates that 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-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-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-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-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole?
The CAS number of 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole is 311775-78-7.
What is the molecular formula of 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole?
The molecular formula of 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole is C19H13F2N3OS.
What is the molecular weight of 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole?
The molecular weight of 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole is 369.07 g/mol.
Where can I buy 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole?
You can request a quote for 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-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-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2,6-Difluorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-phenyl-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.