![6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol structure](/static/products/661/66129-30-4.png)
6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol
TL;DR: 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol (CAS 66129-30-4) is a chemical compound with molecular formula C11H8N4S and molecular weight 228.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenyl-2H-[1,2,4]triazolo[4,3-b]pyridazine-3-thione
Also Known As: 6-phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol, 6-phenyl-2H-[1,2,4]triazolo[4,3-b]pyridazine-3-thione, F1967-1099, 6-Phenyl[1,2,4]triazolo[4,3-b]pyridazine-3(2H)-thione
| Molecular Formula | C11H8N4S |
|---|---|
| Molecular Weight | 228.05 g/mol |
| LogP | 2.45389 |
| Topological Polar Surface Area | 45.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.04697 |
| Heavy Atoms | 16 |
| Complexity | 683.776 |
Chemical Identifiers
| CAS Number | 66129-30-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN3C(=NNC3=S)C=C2 |
Product Overview
6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol (CAS 66129-30-4), with molecular formula C11H8N4S and molecular weight 228.05 g/mol. IUPAC: 6-phenyl-2H-[1,2,4]triazolo[4,3-b]pyridazine-3-thione.
Chemical Property Profile of 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol
Property Insights of 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol
The XLogP value of 2.45389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol. With a topological polar surface area (TPSA) of 45.98 Ų, 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol has 1 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 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol?
The CAS number of 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol is 66129-30-4.
What is the molecular formula of 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol?
The molecular formula of 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol is C11H8N4S.
What is the molecular weight of 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol?
The molecular weight of 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol is 228.05 g/mol.
Where can I buy 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol?
You can request a quote for 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenyl-[1,2,4]triazolo[4,3-b]pyridazine-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.