![6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole structure](/static/products/7918/791824-33-4.webp)
6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
TL;DR: 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 791824-33-4) is a chemical compound with molecular formula C17H11FN4O2S and molecular weight 354.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-(4-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43113642, 6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-(4-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(2,3-dihydrobenzo[b][1,4]dioxin-2-yl)-3-(4-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C17H11FN4O2S |
|---|---|
| Molecular Weight | 354.06 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.0587 |
| Heavy Atoms | 25 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 791824-33-4 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)C3=NN4C(=NN=C4S3)C5=CC=C(C=C5)F |
| InChIKey | NHKJEYJACBRRFO-UHFFFAOYSA-N |
Product Overview
6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 791824-33-4), with molecular formula C17H11FN4O2S and molecular weight 354.06 g/mol. IUPAC: 6-(2,3-dihydro-1,4-benzodioxin-3-yl)-3-(4-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Property Insights of 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
The XLogP value of 3.3 indicates that 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. Following Lipinski's Rule of Five, 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[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-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The CAS number of 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 791824-33-4.
What is the molecular formula of 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular formula of 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is C17H11FN4O2S.
What is the molecular weight of 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular weight of 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 354.06 g/mol.
Where can I buy 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
You can request a quote for 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[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-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-(2,3-dihydro-1,4-benzodioxin-2-yl)-3-(4-fluorophenyl)[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.