![([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid structure](/static/products/1147/114722-63-3.webp)
([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid
TL;DR: ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid (CAS 114722-63-3) is a chemical compound with molecular formula C10H7N3O2S2 and molecular weight 265.00 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)acetic acid
Also Known As: ([1,2,4]TRIAZOLO[3,4-B][1,3]BENZOTHIAZOL-3-YLTHIO)ACETIC ACID, AKOS BC-3151, IFLab1_000836, Pyrazolo<2,3-a>chinazolin-4-ol, 9500AC
| Molecular Formula | C10H7N3O2S2 |
|---|---|
| Molecular Weight | 265.00 g/mol |
| LogP | 2.1207 |
| Topological Polar Surface Area | 67.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.99796 |
| Heavy Atoms | 17 |
| Complexity | 703.77826 |
Chemical Identifiers
| CAS Number | 114722-63-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C(=NN=C3SCC(=O)O)S2 |
Product Overview
([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid (CAS 114722-63-3), with molecular formula C10H7N3O2S2 and molecular weight 265.00 g/mol. IUPAC: 2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetic acid.
Chemical Property Profile of ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid
Property Insights of ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid
The XLogP value of 2.1207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid. The TPSA of 67.49 Ų falls within the moderate polarity range, balancing permeability and solubility for ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid. Following Lipinski's Rule of Five, ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid 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 ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid?
The CAS number of ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid is 114722-63-3.
What is the molecular formula of ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid?
The molecular formula of ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid is C10H7N3O2S2.
What is the molecular weight of ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid?
The molecular weight of ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid is 265.00 g/mol.
Where can I buy ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid?
You can request a quote for ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for ([1,2,4]Triazolo[3,4-B][1,3]benzothiazol-3-ylthio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.