![5-Bromo-2-(methylthio)benzo[d]thiazole structure](/static/products/2033/203395-29-3.webp)
5-Bromo-2-(methylthio)benzo[d]thiazole
TL;DR: 5-Bromo-2-(methylthio)benzo[d]thiazole (CAS 203395-29-3) is a chemical compound with molecular formula C8H6BrNS2 and molecular weight 258.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-methylsulfanyl-1,3-benzothiazole
Also Known As: 5-Bromo-2-(methylthio)benzo[d]thiazole, 5-Bromo-2-(methylthio)benzothiazole, Benzothiazole, 5-bromo-2-(methylthio)-, 5-bromo-2-methylsulfanyl-1,3-benzothiazole, 5-bromo-2-(methylthio)-1,3-benzothiazole
| Molecular Formula | C8H6BrNS2 |
|---|---|
| Molecular Weight | 258.91 g/mol |
| LogP | 3.7807 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.9125 |
| Heavy Atoms | 12 |
| Complexity | 410.3501 |
Chemical Identifiers
| CAS Number | 203395-29-3 |
|---|---|
| SMILES | CSC1=NC2=C(S1)C=CC(=C2)Br |
Product Overview
5-Bromo-2-(methylthio)benzo[d]thiazole (CAS 203395-29-3), with molecular formula C8H6BrNS2 and molecular weight 258.91 g/mol. IUPAC: 5-bromo-2-methylsulfanyl-1,3-benzothiazole.
Chemical Property Profile of 5-Bromo-2-(methylthio)benzo[d]thiazole
Property Insights of 5-Bromo-2-(methylthio)benzo[d]thiazole
The XLogP value of 3.7807 indicates that 5-Bromo-2-(methylthio)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, 5-Bromo-2-(methylthio)benzo[d]thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-(methylthio)benzo[d]thiazole 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 5-Bromo-2-(methylthio)benzo[d]thiazole?
The CAS number of 5-Bromo-2-(methylthio)benzo[d]thiazole is 203395-29-3.
What is the molecular formula of 5-Bromo-2-(methylthio)benzo[d]thiazole?
The molecular formula of 5-Bromo-2-(methylthio)benzo[d]thiazole is C8H6BrNS2.
What is the molecular weight of 5-Bromo-2-(methylthio)benzo[d]thiazole?
The molecular weight of 5-Bromo-2-(methylthio)benzo[d]thiazole is 258.91 g/mol.
Where can I buy 5-Bromo-2-(methylthio)benzo[d]thiazole?
You can request a quote for 5-Bromo-2-(methylthio)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 5-Bromo-2-(methylthio)benzo[d]thiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-(methylthio)benzo[d]thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.