![2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole structure](/static/products/1895/189579-62-2.webp)
2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole
TL;DR: 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole (CAS 189579-62-2) is a chemical compound with molecular formula C12H9NS3 and molecular weight 262.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(thiophen-2-ylmethylsulfanyl)-1,3-benzothiazole
Also Known As: IFLab1_003478, 2-(2-thienylmethylthio)benzothiazole, 2-[(2-Thenyl)thio]benzothiazole, 2-((thiophen-2-ylmethyl)thio)benzo[d]thiazole, 2-(2-thenylthio)-1,3-benzothiazole
| Molecular Formula | C12H9NS3 |
|---|---|
| Molecular Weight | 262.99 g/mol |
| LogP | 4.6501 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.98972 |
| Heavy Atoms | 16 |
| Complexity | 550.1211 |
Chemical Identifiers
| CAS Number | 189579-62-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)SCC3=CC=CS3 |
Product Overview
2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole (CAS 189579-62-2), with molecular formula C12H9NS3 and molecular weight 262.99 g/mol. IUPAC: 2-(thiophen-2-ylmethylsulfanyl)-1,3-benzothiazole.
Chemical Property Profile of 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole
Property Insights of 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole
The XLogP value of 4.6501 indicates that 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole has 0 hydrogen bond donor(s) and 4 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-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole?
The CAS number of 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole is 189579-62-2.
What is the molecular formula of 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole?
The molecular formula of 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole is C12H9NS3.
What is the molecular weight of 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole?
The molecular weight of 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole is 262.99 g/mol.
Where can I buy 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole?
You can request a quote for 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-((Thiophen-2-ylmethyl)thio)benzo[d]thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.