4-Methyl-1-phenacyl-quinolinium bromide
TL;DR: 4-Methyl-1-phenacyl-quinolinium bromide (CAS 136714-38-0) is a chemical compound with molecular formula C18H16BrNO and molecular weight 341.04153 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methylquinolin-1-ium-1-yl)-1-phenylethanone bromide
Also Known As: 4-methyl-1-phenacyl-quinolinium bromide, 2-(4-methylquinolin-1-yl)-1-phenyl-ethanone Bromide, 4-methyl-1-(2-oxo-2-phenylethyl)quinolinium bromide, 1-[2-phenyl-2-oxoethyl]-4-methylquinolin-1-ium bromide, 2-(4-methylquinolin-1-ium-1-yl)-1-phenylethanone bromide
Technical Specifications
| Molecular Formula | C18H16BrNO |
| Molecular Weight | 341.04153 g/mol |
| XLogP | 0.32262 |
| Topological Polar Surface Area (TPSA) | 21.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.04153 Da |
| Heavy Atoms | 21 |
| Complexity | 334.0 |
| SMILES | CC1=CC=[N+](C2=CC=CC=C12)CC(=O)C3=CC=CC=C3.[Br-] |
| InChIKey | QXOQPNUCSQCQIK-UHFFFAOYSA-M |
Chemical Property Profile of 4-Methyl-1-phenacyl-quinolinium bromide
Property Insights of 4-Methyl-1-phenacyl-quinolinium bromide
The XLogP value of 0.32262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-1-phenacyl-quinolinium bromide. With a topological polar surface area (TPSA) of 21.0 Ų, 4-Methyl-1-phenacyl-quinolinium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-1-phenacyl-quinolinium bromide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Methyl-1-phenacyl-quinolinium bromide?
The CAS number of 4-Methyl-1-phenacyl-quinolinium bromide is 136714-38-0.
What is the molecular formula of 4-Methyl-1-phenacyl-quinolinium bromide?
The molecular formula of 4-Methyl-1-phenacyl-quinolinium bromide is C18H16BrNO.
What is the molecular weight of 4-Methyl-1-phenacyl-quinolinium bromide?
The molecular weight of 4-Methyl-1-phenacyl-quinolinium bromide is 341.04153 g/mol.
Where can I buy 4-Methyl-1-phenacyl-quinolinium bromide?
You can request a quote for 4-Methyl-1-phenacyl-quinolinium bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-1-phenacyl-quinolinium bromide?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-1-phenacyl-quinolinium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.