3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one
TL;DR: 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one (CAS 139781-14-9) is a chemical compound with molecular formula C17H12BrNO2 and molecular weight 341.00513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-acetyl-6-bromo-4-phenyl-1H-quinolin-2-one
Also Known As: 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one, 3-Acetyl-6-bromo-4-phenyl-1H-quinolin-2-one, 2(1H)-Quinolinone, 3-acetyl-6-bromo-4-phenyl-, BAS 00108168, 3-acetyl-6-bromo-4-phenyl-1,2-dihydroquinolin-2-one
Technical Specifications
| Molecular Formula | C17H12BrNO2 |
| Molecular Weight | 341.00513 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.00513 Da |
| Heavy Atoms | 21 |
| Complexity | 479.0 |
| SMILES | CC(=O)C1=C(C2=C(C=CC(=C2)Br)NC1=O)C3=CC=CC=C3 |
| InChIKey | FXROTDSWXRSXMK-UHFFFAOYSA-N |
Chemical Property Profile of 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one
Property Insights of 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one
The XLogP value of 3.1 indicates that 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one has 1 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 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one?
The CAS number of 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one is 139781-14-9.
What is the molecular formula of 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one?
The molecular formula of 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one is C17H12BrNO2.
What is the molecular weight of 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one?
The molecular weight of 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one is 341.00513 g/mol.
Where can I buy 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one?
You can request a quote for 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for 3-Acetyl-6-bromo-4-phenylquinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.