![6-Bromo-3-methylthieno[2,3-d]isothiazole structure](/static/products/887/887585-93-5.png)
6-Bromo-3-methylthieno[2,3-d]isothiazole
TL;DR: 6-Bromo-3-methylthieno[2,3-d]isothiazole (CAS 887585-93-5) is a chemical compound with molecular formula C6H4BrNS2 and molecular weight 232.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-methylthieno[2,3-d][1,2]thiazole
Also Known As: 6-bromo-3-methylthieno[2,3-d]isothiazole, 6-bromo-3-methylthieno[2,3-d][1,2]thiazole, 6-bromo-3-methylthiopheno[2,3-d]isothiazole, AP-836/41220402
| Molecular Formula | C6H4BrNS2 |
|---|---|
| Molecular Weight | 232.90 g/mol |
| LogP | 3.42872 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.89685 |
| Heavy Atoms | 10 |
| Complexity | 326.5872 |
Chemical Identifiers
| CAS Number | 887585-93-5 |
|---|---|
| SMILES | CC1=NSC2=C1SC=C2Br |
Product Overview
6-Bromo-3-methylthieno[2,3-d]isothiazole (CAS 887585-93-5), with molecular formula C6H4BrNS2 and molecular weight 232.90 g/mol. IUPAC: 6-bromo-3-methylthieno[2,3-d][1,2]thiazole.
Chemical Property Profile of 6-Bromo-3-methylthieno[2,3-d]isothiazole
Property Insights of 6-Bromo-3-methylthieno[2,3-d]isothiazole
The XLogP value of 3.42872 indicates that 6-Bromo-3-methylthieno[2,3-d]isothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 6-Bromo-3-methylthieno[2,3-d]isothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-3-methylthieno[2,3-d]isothiazole 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 6-Bromo-3-methylthieno[2,3-d]isothiazole?
The CAS number of 6-Bromo-3-methylthieno[2,3-d]isothiazole is 887585-93-5.
What is the molecular formula of 6-Bromo-3-methylthieno[2,3-d]isothiazole?
The molecular formula of 6-Bromo-3-methylthieno[2,3-d]isothiazole is C6H4BrNS2.
What is the molecular weight of 6-Bromo-3-methylthieno[2,3-d]isothiazole?
The molecular weight of 6-Bromo-3-methylthieno[2,3-d]isothiazole is 232.90 g/mol.
Where can I buy 6-Bromo-3-methylthieno[2,3-d]isothiazole?
You can request a quote for 6-Bromo-3-methylthieno[2,3-d]isothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-3-methylthieno[2,3-d]isothiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-3-methylthieno[2,3-d]isothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.