![[1,2,3]Triazolo[5,1-b]benzothiazole structure](/static/products/7208/72088-47-2.webp)
[1,2,3]Triazolo[5,1-b]benzothiazole
TL;DR: [1,2,3]Triazolo[5,1-b]benzothiazole (CAS 72088-47-2) is a chemical compound with molecular formula C8H5N3S and molecular weight 175.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triazolo[5,1-b][1,3]benzothiazole
Also Known As: [1,2,3]Triazolo[5,1-b]benzothiazole|triazolo[5,1-b][1,3]benzothiazole|[1,2,3]Triazolo[5,1-b][1,3]benzothiazole|12H-benzothiazolo[2,3-b]quinazolin-12-one, 8-chloro-1,2,3,4-tetrahydro-|7-thia-2,3,4-triazatricyclo[6.4.0.02,6]dodeca-1(12),3,5,8,10-pentaene|8-chloro-1,2,3,4-tetrahydro-12H-[1,3]benzothiazolo[2,3-b]quinazolin-12-one|InChI=1/C8H5N3S/c1-2-4-7-6(3-1)11-8(12-7)5-9-10-11/h1-5
| Molecular Formula | C8H5N3S |
|---|---|
| Molecular Weight | 175.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 58.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.02042 |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 72088-47-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C(=CN=N3)S2 |
| InChIKey | GERHYQHSGHDHBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[1,2,3]Triazolo[5,1-b]benzothiazole (CAS 72088-47-2), with molecular formula C8H5N3S and molecular weight 175.02 g/mol. IUPAC: triazolo[5,1-b][1,3]benzothiazole.
Chemical Property Profile of [1,2,3]Triazolo[5,1-b]benzothiazole
Property Insights of [1,2,3]Triazolo[5,1-b]benzothiazole
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1,2,3]Triazolo[5,1-b]benzothiazole. With a topological polar surface area (TPSA) of 58.4 Ų, [1,2,3]Triazolo[5,1-b]benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,2,3]Triazolo[5,1-b]benzothiazole has 0 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 [1,2,3]Triazolo[5,1-b]benzothiazole?
The CAS number of [1,2,3]Triazolo[5,1-b]benzothiazole is 72088-47-2.
What is the molecular formula of [1,2,3]Triazolo[5,1-b]benzothiazole?
The molecular formula of [1,2,3]Triazolo[5,1-b]benzothiazole is C8H5N3S.
What is the molecular weight of [1,2,3]Triazolo[5,1-b]benzothiazole?
The molecular weight of [1,2,3]Triazolo[5,1-b]benzothiazole is 175.02 g/mol.
Where can I buy [1,2,3]Triazolo[5,1-b]benzothiazole?
You can request a quote for [1,2,3]Triazolo[5,1-b]benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,2,3]Triazolo[5,1-b]benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for [1,2,3]Triazolo[5,1-b]benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.