Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-
TL;DR: Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- (CAS 73932-11-3) is a chemical compound with molecular formula C12H12N2OS and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone
Also Known As: 2-(1-Imidazolyl)-4'-(methylthio)acetophenone, ACETOPHENONE, 2-(1-IMIDAZOLYL)-4'-(METHYLTHIO)-, 2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone, 2-(1H-imidazol-1-yl)-1-[4-(methylsulfanyl)phenyl]ethan-1-one, alpha-(1H-Imidazol-1-yl)-4 -(methylthio)acetophenone
| Molecular Formula | C12H12N2OS |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.06703 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 73932-11-3 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)C(=O)CN2C=CN=C2 |
| InChIKey | XOCANYCBIQEMJX-UHFFFAOYSA-N |
Product Overview
Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- (CAS 73932-11-3), with molecular formula C12H12N2OS and molecular weight 232.07 g/mol. IUPAC: 2-imidazol-1-yl-1-(4-methylsulfanylphenyl)ethanone.
Chemical Property Profile of Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-
Property Insights of Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-. Following Lipinski's Rule of Five, Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- 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 Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-?
The CAS number of Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- is 73932-11-3.
What is the molecular formula of Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-?
The molecular formula of Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- is C12H12N2OS.
What is the molecular weight of Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-?
The molecular weight of Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- is 232.07 g/mol.
Where can I buy Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-?
You can request a quote for Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Acetophenone, 2-(1-imidazolyl)-4'-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.