6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one
TL;DR: 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one (CAS 120285-10-1) is a chemical compound with molecular formula C15H11F2NO and molecular weight 259.08087 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one
Also Known As: 1-(2-Fluorophenyl)-6-fluoro-1,2-dihydroisoquinolin-3(4H)-one, 6-fluoro-1-(2-fluorophenyl)-1,2-dihydroisoquinolin-3(4H)-one, 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one, 6-fluoro-1-(2-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-3-one
Technical Specifications
| Molecular Formula | C15H11F2NO |
| Molecular Weight | 259.08087 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.08087 Da |
| Heavy Atoms | 19 |
| Complexity | 349.0 |
| SMILES | C1C2=C(C=CC(=C2)F)C(NC1=O)C3=CC=CC=C3F |
| InChIKey | DJFSCBMBGUCVDK-UHFFFAOYSA-N |
Chemical Property Profile of 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one
Property Insights of 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one. With a topological polar surface area (TPSA) of 29.1 Ų, 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one has 1 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 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one?
The CAS number of 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one is 120285-10-1.
What is the molecular formula of 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one?
The molecular formula of 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one is C15H11F2NO.
What is the molecular weight of 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one?
The molecular weight of 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one is 259.08087 g/mol.
Where can I buy 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one?
You can request a quote for 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one?
Yes, CoreyChem provides custom synthesis services for 6-fluoro-1-(2-fluorophenyl)-2,4-dihydro-1H-isoquinolin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.