2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol
TL;DR: 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol (CAS 423740-66-3) is a chemical compound with molecular formula C10H9N3OS2 and molecular weight 251.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanol
Also Known As: 2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol, 2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanol, ethanol, 2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)-, 2-(1,2,4Triazolo3,4-b1,3benzothiazol-3-ylthio)ethanol, 2-(Benzo[4,5]thiazolo[2,3-c][1,2,4]triazol-3-ylthio)ethan-1-ol
| Molecular Formula | C10H9N3OS2 |
|---|---|
| Molecular Weight | 251.02 g/mol |
| LogP | 2.0284 |
| Topological Polar Surface Area | 50.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.0187 |
| Heavy Atoms | 16 |
| Complexity | 631.10364 |
Chemical Identifiers
| CAS Number | 423740-66-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C(=NN=C3SCCO)S2 |
Product Overview
2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol (CAS 423740-66-3), with molecular formula C10H9N3OS2 and molecular weight 251.02 g/mol. IUPAC: 2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanol.
Chemical Property Profile of 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol
Property Insights of 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol
The XLogP value of 2.0284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol. With a topological polar surface area (TPSA) of 50.42 Ų, 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol has 1 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 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol?
The CAS number of 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol is 423740-66-3.
What is the molecular formula of 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol?
The molecular formula of 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol is C10H9N3OS2.
What is the molecular weight of 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol?
The molecular weight of 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol is 251.02 g/mol.
Where can I buy 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol?
You can request a quote for 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-([1,2,4]Triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.