6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol
TL;DR: 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol (CAS 243444-81-7) is a chemical compound with molecular formula C6H3Cl2N3S and molecular weight 218.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dichloro-2H-[1,2,4]triazolo[4,3-a]pyridine-3-thione
Also Known As: 6,8-Dichloro-[1,2,4]triazolo[4,3-a]pyridine-3-thiol, 6,8-dichloro-2H-[1,2,4]triazolo[4,3-a]pyridine-3-thione, J1.129.042F, 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol, 6,8-dichloro-2H,3H-[1,2,4]triazolo[4,3-a]pyridine-3-thione
| Molecular Formula | C6H3Cl2N3S |
|---|---|
| Molecular Weight | 218.94 g/mol |
| LogP | 2.69869 |
| Topological Polar Surface Area | 33.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.94247 |
| Heavy Atoms | 12 |
| Complexity | 486.98914 |
Chemical Identifiers
| CAS Number | 243444-81-7 |
|---|---|
| SMILES | C1=C(C2=NNC(=S)N2C=C1Cl)Cl |
Product Overview
6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol (CAS 243444-81-7), with molecular formula C6H3Cl2N3S and molecular weight 218.94 g/mol. IUPAC: 6,8-dichloro-2H-[1,2,4]triazolo[4,3-a]pyridine-3-thione.
Chemical Property Profile of 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol
Property Insights of 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol
The XLogP value of 2.69869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol. With a topological polar surface area (TPSA) of 33.09 Ų, 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol has 1 hydrogen bond donor(s) and 2 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 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol?
The CAS number of 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol is 243444-81-7.
What is the molecular formula of 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol?
The molecular formula of 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol is C6H3Cl2N3S.
What is the molecular weight of 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol?
The molecular weight of 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol is 218.94 g/mol.
Where can I buy 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol?
You can request a quote for 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol?
Yes, KEHONG BIO provides custom synthesis services for 6,8-Dichloro-(1,2,4)triazolo(4,3-a)pyridine-3-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.