6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole
TL;DR: 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole (CAS 83676-82-8) is a chemical compound with molecular formula C16H12N4OS and molecular weight 308.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(phenoxymethyl)-3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: ChemDiv3_006807, 6-(Phenoxymethyl)-3-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, IDI1_024717, 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole, 6-(phenoxymethyl)-3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C16H12N4OS |
|---|---|
| Molecular Weight | 308.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.07318 |
| Heavy Atoms | 22 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 83676-82-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)COC4=CC=CC=C4 |
| InChIKey | JBBHXXMWRDMODG-UHFFFAOYSA-N |
Product Overview
6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole (CAS 83676-82-8), with molecular formula C16H12N4OS and molecular weight 308.07 g/mol. IUPAC: 6-(phenoxymethyl)-3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole
Property Insights of 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole
The XLogP value of 3.4 indicates that 6-(Phenoxymethyl)-3-phenyl(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 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole. Following Lipinski's Rule of Five, 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole has 0 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 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole?
The CAS number of 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole is 83676-82-8.
What is the molecular formula of 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole?
The molecular formula of 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole is C16H12N4OS.
What is the molecular weight of 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole?
The molecular weight of 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole is 308.07 g/mol.
Where can I buy 6-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole?
You can request a quote for 6-(Phenoxymethyl)-3-phenyl(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-(Phenoxymethyl)-3-phenyl(1,2,4)triazolo(3,4-b)(1,3,4)thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-(Phenoxymethyl)-3-phenyl(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.