TL;DR: 6-Chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione (CAS 144603-88-3) is a chemical compound with molecular formula C16H11ClFNO3 and molecular weight 319.04114 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-3-fluoro-7-methoxy-3-phenyl-1H-quinoline-2,4-dione
Also Known As: 6-chloro-3-fluoro-7-methoxy-3-phenyl-1H-quinoline-2,4-dione, 6-chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione
| Molecular Formula | C16H11ClFNO3 |
| Molecular Weight | 319.04114 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.04114 Da |
| Heavy Atoms | 22 |
| Complexity | 468.0 |
| SMILES | COC1=C(C=C2C(=C1)NC(=O)C(C2=O)(C3=CC=CC=C3)F)Cl |
| InChIKey | LMERJRVGFBHEIQ-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 6-Chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 6-Chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-Chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione is 144603-88-3.
The molecular formula of 6-Chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione is C16H11ClFNO3.
The molecular weight of 6-Chloro-3-fluoro-7-methoxy-3-phenyl-1,2,3,4-tetrahydroquinoline-2,4-dione is 319.04114 g/mol.
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