2-Imidazoline, 1-acetyl-2-allylthio-
TL;DR: 2-Imidazoline, 1-acetyl-2-allylthio- (CAS 61076-81-1) is a chemical compound with molecular formula C8H12N2OS and molecular weight 184.06703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-prop-2-enylsulfanyl-4,5-dihydroimidazol-1-yl)ethanone
Also Known As: 3-Acetyl-2-allylthio-2-imidazoline, Imidazolidine, 3-acetyl-2-allylthio-, 2-IMIDAZOLINE, 1-ACETYL-2-ALLYLTHIO-, 5-23-10-00433 (Beilstein Handbook Reference), 1-(2-prop-2-enylsulfanyl-4,5-dihydroimidazol-1-yl)ethanone
Technical Specifications
| Molecular Formula | C8H12N2OS |
| Molecular Weight | 184.06703 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.06703 Da |
| Heavy Atoms | 12 |
| Complexity | 225.0 |
| SMILES | CC(=O)N1CCN=C1SCC=C |
| InChIKey | QKUXYLKNCQTHSR-UHFFFAOYSA-N |
Chemical Property Profile of 2-Imidazoline, 1-acetyl-2-allylthio-
Property Insights of 2-Imidazoline, 1-acetyl-2-allylthio-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Imidazoline, 1-acetyl-2-allylthio-. With a topological polar surface area (TPSA) of 58.0 Ų, 2-Imidazoline, 1-acetyl-2-allylthio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Imidazoline, 1-acetyl-2-allylthio- 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
What is the CAS number of 2-Imidazoline, 1-acetyl-2-allylthio-?
The CAS number of 2-Imidazoline, 1-acetyl-2-allylthio- is 61076-81-1.
What is the molecular formula of 2-Imidazoline, 1-acetyl-2-allylthio-?
The molecular formula of 2-Imidazoline, 1-acetyl-2-allylthio- is C8H12N2OS.
What is the molecular weight of 2-Imidazoline, 1-acetyl-2-allylthio-?
The molecular weight of 2-Imidazoline, 1-acetyl-2-allylthio- is 184.06703 g/mol.
Where can I buy 2-Imidazoline, 1-acetyl-2-allylthio-?
You can request a quote for 2-Imidazoline, 1-acetyl-2-allylthio- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Imidazoline, 1-acetyl-2-allylthio-?
Yes, CoreyChem provides custom synthesis services for 2-Imidazoline, 1-acetyl-2-allylthio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.