TL;DR: 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone (CAS 866143-47-7) is a chemical compound with molecular formula C16H12ClFN2O and molecular weight 302.06223 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-chlorophenyl)-3-(3-fluorophenyl)-4,5-dihydro-1H-pyridazin-6-one
Also Known As: 9K-522S, 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone, 5-(4-chlorophenyl)-3-(3-fluorophenyl)-4,5-dihydro-1H-pyridazin-6-one, 4-(4-chlorophenyl)-6-(3-fluorophenyl)-2,3,4,5-tetrahydropyridazin-3-one, 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-2H-pyridazin-3-one
| Molecular Formula | C16H12ClFN2O |
| Molecular Weight | 302.06223 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.06223 Da |
| Heavy Atoms | 21 |
| Complexity | 421.0 |
| SMILES | C1C(C(=O)NN=C1C2=CC(=CC=C2)F)C3=CC=C(C=C3)Cl |
| InChIKey | YSHZZSZOQRSCJK-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.5 Ų, 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone is 866143-47-7.
The molecular formula of 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone is C16H12ClFN2O.
The molecular weight of 4-(4-chlorophenyl)-6-(3-fluorophenyl)-4,5-dihydro-3(2H)-pyridazinone is 302.06223 g/mol.
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