![3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine structure](/static/products/2967/296797-19-8.webp)
3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine
TL;DR: 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine (CAS 296797-19-8) is a chemical compound with molecular formula C8H4BrF3N2S and molecular weight 295.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-6-methyl-4-(trifluoromethyl)-[1,2]thiazolo[5,4-b]pyridine
Also Known As: 3-bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine, ZERO/005747, 3-bromo-6-methyl-4-(trifluoromethyl)[1,2]thiazolo[5,4-b]pyridine, 3-bromo-6-methyl-4-(trifluoromethyl)-[1,2]thiazolo[5,4-b]pyridine, W-7161
| Molecular Formula | C8H4BrF3N2S |
|---|---|
| Molecular Weight | 295.92 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 295.92307 |
| Heavy Atoms | 15 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 296797-19-8 |
|---|---|
| SMILES | CC1=CC(=C2C(=N1)SN=C2Br)C(F)(F)F |
| InChIKey | XXVIPNOTHSIXQJ-UHFFFAOYSA-N |
Product Overview
3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine (CAS 296797-19-8), with molecular formula C8H4BrF3N2S and molecular weight 295.92 g/mol. IUPAC: 3-bromo-6-methyl-4-(trifluoromethyl)-[1,2]thiazolo[5,4-b]pyridine.
Chemical Property Profile of 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine
Property Insights of 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine
The XLogP value of 3.9 indicates that 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine has 0 hydrogen bond donor(s) and 6 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 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine?
The CAS number of 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine is 296797-19-8.
What is the molecular formula of 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine?
The molecular formula of 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine is C8H4BrF3N2S.
What is the molecular weight of 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine?
The molecular weight of 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine is 295.92 g/mol.
Where can I buy 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine?
You can request a quote for 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-6-methyl-4-(trifluoromethyl)isothiazolo[5,4-b]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.