![2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole structure](/static/products/848/848921-80-2.png)
2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole
TL;DR: 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole (CAS 848921-80-2) is a chemical compound with molecular formula C22H19N5OS and molecular weight 401.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-benzimidazole
Also Known As: 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole, 2-({[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole, 2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-benzimidazole, 2-[[[4-(2-furfuryl)-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-benzimidazole, 2-[[[4-(2-furanylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-benzimidazole
| Molecular Formula | C22H19N5OS |
|---|---|
| Molecular Weight | 401.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 97.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.13104 |
| Heavy Atoms | 29 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 848921-80-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=NC5=CC=CC=C5N4 |
| InChIKey | SRYGSUNSRPMAMF-UHFFFAOYSA-N |
Product Overview
2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole (CAS 848921-80-2), with molecular formula C22H19N5OS and molecular weight 401.13 g/mol. IUPAC: 2-[[4-(furan-2-ylmethyl)-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-benzimidazole.
Chemical Property Profile of 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole
Property Insights of 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole
The XLogP value of 4.1 indicates that 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole. Following Lipinski's Rule of Five, 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole has 1 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 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole?
The CAS number of 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole is 848921-80-2.
What is the molecular formula of 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole?
The molecular formula of 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole is C22H19N5OS.
What is the molecular weight of 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole?
The molecular weight of 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole is 401.13 g/mol.
Where can I buy 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole?
You can request a quote for 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(((4-(furan-2-ylmethyl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)-1H-benzo[d]imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.