KST-1B0022
TL;DR: KST-1B0022 (CAS 108905-64-2) is a chemical compound with molecular formula C12H13BrN4OS and molecular weight 340.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromo-3-methyl-2-methylsulfanylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanone
Also Known As: KST-1B0022, Ethanone, 1-(4-bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazinyl)-, 1-[4-bromo-1-methyl-2-(methylsulfanyl)-1h-imidazol-5-yl]-2-(5-methylpyrazin-2-yl)ethanone, 1-(4-Bromo-1-methyl-2-(methylthio)-1H-imidazol-5-yl)-2-(5-methylpyrazin-2-yl)ethanone, 1-(5-bromo-3-methyl-2-methylsulfanylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanone
| Molecular Formula | C12H13BrN4OS |
|---|---|
| Molecular Weight | 340.00 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 86.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.99933 |
| Heavy Atoms | 19 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 108905-64-2 |
|---|---|
| SMILES | CC1=CN=C(C=N1)CC(=O)C2=C(N=C(N2C)SC)Br |
| InChIKey | FOYMYNLHXGYIFM-UHFFFAOYSA-N |
Product Overview
KST-1B0022 (CAS 108905-64-2), with molecular formula C12H13BrN4OS and molecular weight 340.00 g/mol. IUPAC: 1-(5-bromo-3-methyl-2-methylsulfanylimidazol-4-yl)-2-(5-methylpyrazin-2-yl)ethanone.
Chemical Property Profile of KST-1B0022
Property Insights of KST-1B0022
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1B0022. The TPSA of 86.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1B0022. Following Lipinski's Rule of Five, KST-1B0022 has 0 hydrogen bond donor(s) and 5 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 KST-1B0022?
The CAS number of KST-1B0022 is 108905-64-2.
What is the molecular formula of KST-1B0022?
The molecular formula of KST-1B0022 is C12H13BrN4OS.
What is the molecular weight of KST-1B0022?
The molecular weight of KST-1B0022 is 340.00 g/mol.
Where can I buy KST-1B0022?
You can request a quote for KST-1B0022 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B0022?
Yes, KEHONG BIO provides custom synthesis services for KST-1B0022 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.