6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
TL;DR: 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 878434-08-3) is a chemical compound with molecular formula C14H8N4O3S and molecular weight 312.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1,3-benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975532, 6-(1,3-benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43300840, 6-(1,3-benzodioxol-5-yl)-3-(2-furyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, A4131/0176191
| Molecular Formula | C14H8N4O3S |
|---|---|
| Molecular Weight | 312.03 g/mol |
| LogP | 2.8415 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.0317 |
| Heavy Atoms | 22 |
| Complexity | 973.4814 |
Chemical Identifiers
| CAS Number | 878434-08-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=NN4C(=NN=C4S3)C5=CC=CO5 |
Product Overview
6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 878434-08-3), with molecular formula C14H8N4O3S and molecular weight 312.03 g/mol. IUPAC: 6-(1,3-benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Property Insights of 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
The XLogP value of 2.8415 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. Following Lipinski's Rule of Five, 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole has 0 hydrogen bond donor(s) and 7 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 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The CAS number of 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 878434-08-3.
What is the molecular formula of 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular formula of 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is C14H8N4O3S.
What is the molecular weight of 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular weight of 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 312.03 g/mol.
Where can I buy 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
You can request a quote for 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-(1,3-Benzodioxol-5-yl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.