1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline
TL;DR: 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline (CAS 121568-13-6) is a chemical compound with molecular formula C11H11FN2OS and molecular weight 238.05762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-fluorophenyl)-(2-methylsulfanyl-4,5-dihydroimidazol-1-yl)methanone
Also Known As: 1-(2-fluorobenzoyl)-2-methylthio-2-imidazoline, F0630-0031, 1-(2-fluorobenzoyl)-2-(methylthio)-4,5-dihydro-1H-imidazole, 1-(2-fluorobenzoyl)-2-(methylsulfanyl)-4,5-dihydro-1H-imidazole, (2-fluorophenyl)(2-(methylthio)-4,5-dihydro-1H-imidazol-1-yl)methanone
Technical Specifications
| Molecular Formula | C11H11FN2OS |
| Molecular Weight | 238.05762 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.05762 Da |
| Heavy Atoms | 16 |
| Complexity | 308.0 |
| SMILES | CSC1=NCCN1C(=O)C2=CC=CC=C2F |
| InChIKey | AJLXZOMOYYPBTR-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline
Property Insights of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline. With a topological polar surface area (TPSA) of 58.0 Ų, 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline?
The CAS number of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline is 121568-13-6.
What is the molecular formula of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline?
The molecular formula of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline is C11H11FN2OS.
What is the molecular weight of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline?
The molecular weight of 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline is 238.05762 g/mol.
Where can I buy 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline?
You can request a quote for 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline?
Yes, CoreyChem provides custom synthesis services for 1-(2-Fluorobenzoyl)-2-methylthio-2-imidazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.