4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol
TL;DR: 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol (CAS 847783-67-9) is a chemical compound with molecular formula C15H12N4OS and molecular weight 296.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(furan-2-ylmethyl)-3-(1H-indol-3-yl)-1H-1,2,4-triazole-5-thione
Also Known As: 4-(furan-2-ylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol, 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol, 4-[(furan-2-yl)methyl]-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol, 4-(furan-2-ylmethyl)-3-(1H-indol-3-yl)-1H-1,2,4-triazole-5-thione, 4-(furan-2-ylmethyl)-5-(1H-indol-3-yl)-2H-1,2,4-triazole-3-thione
| Molecular Formula | C15H12N4OS |
|---|---|
| Molecular Weight | 296.07 g/mol |
| LogP | 3.73029 |
| Topological Polar Surface Area | 62.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.07318 |
| Heavy Atoms | 21 |
| Complexity | 945.5469 |
Chemical Identifiers
| CAS Number | 847783-67-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C3=NNC(=S)N3CC4=CC=CO4 |
Product Overview
4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol (CAS 847783-67-9), with molecular formula C15H12N4OS and molecular weight 296.07 g/mol. IUPAC: 4-(furan-2-ylmethyl)-3-(1H-indol-3-yl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol
Property Insights of 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol
The XLogP value of 3.73029 indicates that 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol. Following Lipinski's Rule of Five, 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol has 2 hydrogen bond donor(s) and 3 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 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol?
The CAS number of 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol is 847783-67-9.
What is the molecular formula of 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol?
The molecular formula of 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol is C15H12N4OS.
What is the molecular weight of 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol?
The molecular weight of 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol is 296.07 g/mol.
Where can I buy 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol?
You can request a quote for 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol 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-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-furylmethyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazole-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.