1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one
TL;DR: 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one (CAS 244278-76-0) is a chemical compound with molecular formula C12H10F2N2OS and molecular weight 268.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-difluorophenyl)-2-(1-methylimidazol-2-yl)sulfanylethanone
Also Known As: 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one, 1-(3,4-difluorophenyl)-2-(1-methylimidazol-2-yl)sulfanylethanone
| Molecular Formula | C12H10F2N2OS |
|---|---|
| Molecular Weight | 268.05 g/mol |
| LogP | 2.6733 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.0482 |
| Heavy Atoms | 18 |
| Complexity | 583.2064 |
Chemical Identifiers
| CAS Number | 244278-76-0 |
|---|---|
| SMILES | CN1C=CN=C1SCC(=O)C2=CC(=C(C=C2)F)F |
Product Overview
1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one (CAS 244278-76-0), with molecular formula C12H10F2N2OS and molecular weight 268.05 g/mol. IUPAC: 1-(3,4-difluorophenyl)-2-(1-methylimidazol-2-yl)sulfanylethanone.
Chemical Property Profile of 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one
Property Insights of 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one
The XLogP value of 2.6733 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one. With a topological polar surface area (TPSA) of 34.89 Ų, 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one 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 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one?
The CAS number of 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one is 244278-76-0.
What is the molecular formula of 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one?
The molecular formula of 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one is C12H10F2N2OS.
What is the molecular weight of 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one?
The molecular weight of 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one is 268.05 g/mol.
Where can I buy 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one?
You can request a quote for 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Difluorophenyl)-2-((1-methyl-1h-imidazol-2-yl)thio)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.