4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide
TL;DR: 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide (CAS 317377-32-5) is a chemical compound with molecular formula C6H8BrNOS and molecular weight 220.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methyl-1,3-thiazol-3-ium-4-yl)ethanone bromide
Also Known As: 4-acetyl-2-methyl-1,3-thiazol-3-ium bromide, 11N-708, 1-(2-methyl-3H-1,3-thiazol-4-yl)ethanone Bromide, 1-(2-methyl-1,3-thiazol-3-ium-4-yl)ethanone bromide, 1-(2-methyl-1,3-thiazol-4-yl)ethan-1-one hydrobromide
| Molecular Formula | C6H8BrNOS |
|---|---|
| Molecular Weight | 220.95 g/mol |
| LogP | -1.92278 |
| Topological Polar Surface Area | 31.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.951 |
| Heavy Atoms | 10 |
| Complexity | 233.40662 |
Chemical Identifiers
| CAS Number | 317377-32-5 |
|---|---|
| SMILES | CC1=[NH+]C(=CS1)C(=O)C.[Br-] |
Product Overview
4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide (CAS 317377-32-5), with molecular formula C6H8BrNOS and molecular weight 220.95 g/mol. IUPAC: 1-(2-methyl-1,3-thiazol-3-ium-4-yl)ethanone bromide.
Chemical Property Profile of 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide
Property Insights of 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide
The XLogP value of -1.92278 indicates that 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 31.21 Ų, 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide has 0 hydrogen bond donor(s) and 2 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 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide?
The CAS number of 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide is 317377-32-5.
What is the molecular formula of 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide?
The molecular formula of 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide is C6H8BrNOS.
What is the molecular weight of 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide?
The molecular weight of 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide is 220.95 g/mol.
Where can I buy 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide?
You can request a quote for 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetyl-2-methyl-1,3-thiazol-3-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.