![4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole structure](/static/products/848/848995-46-0.png)
4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole
TL;DR: 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole (CAS 848995-46-0) is a chemical compound with molecular formula C22H21N3OS and molecular weight 375.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(furan-2-ylmethyl)-3-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole
Also Known As: 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole, 4-(furan-2-ylmethyl)-3-((4-methylbenzyl)thio)-5-(m-tolyl)-4H-1,2,4-triazole, 4-(furan-2-ylmethyl)-3-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole, 4-(furan-2-ylmethyl)-3-[(4-methylbenzyl)sulfanyl]-5-(3-methylphenyl)-4H-1,2,4-triazole, 4-(furan-2-ylmethyl)-3-(3-methylphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
| Molecular Formula | C22H21N3OS |
|---|---|
| Molecular Weight | 375.14 g/mol |
| LogP | 5.49554 |
| Topological Polar Surface Area | 43.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.14053 |
| Heavy Atoms | 27 |
| Complexity | 1020.16473 |
Chemical Identifiers
| CAS Number | 848995-46-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC(=C4)C |
Product Overview
4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole (CAS 848995-46-0), with molecular formula C22H21N3OS and molecular weight 375.14 g/mol. IUPAC: 4-(furan-2-ylmethyl)-3-(3-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole.
Chemical Property Profile of 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole
Property Insights of 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole
The XLogP value of 5.49554 indicates that 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.85 Ų, 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole 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 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole?
The CAS number of 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole is 848995-46-0.
What is the molecular formula of 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole?
The molecular formula of 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole is C22H21N3OS.
What is the molecular weight of 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole?
The molecular weight of 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole is 375.14 g/mol.
Where can I buy 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole?
You can request a quote for 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-furylmethyl)-5-(3-methylphenyl)-3-[(4-methylphenyl)methylthio]-1,2,4-tria zole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.