TL;DR: 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)- (CAS 122322-21-8) is a chemical compound with molecular formula C16H9BrCl3N3O2 and molecular weight 458.89438 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(6-bromo-3-pyridinyl)methoxy]-4-chloro-2-(3,4-dichlorophenyl)pyridazin-3-one
Also Known As: 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)-, 5-((6-Bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)-3(2H)-pyridazinone, 5-[(6-Bromopyridin-3-yl)methoxy]-4-chloro-2-(3,4-dichlorophenyl)pyridazin-3(2H)-one, 5-[(6-bromopyridin-3-yl)methoxy]-4-chloro-2-(3,4-dichlorophenyl)pyridazin-3-one
| Molecular Formula | C16H9BrCl3N3O2 |
| Molecular Weight | 458.89438 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 54.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.89438 Da |
| Heavy Atoms | 25 |
| Complexity | 575.0 |
| SMILES | C1=CC(=C(C=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)Br)Cl)Cl)Cl |
| InChIKey | JAKQAIIXSSLGMZ-UHFFFAOYSA-N |
The XLogP value of 4.8 indicates that 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.8 Ų, 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)- has 0 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 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)- is 122322-21-8.
The molecular formula of 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)- is C16H9BrCl3N3O2.
The molecular weight of 3(2H)-Pyridazinone, 5-((6-bromo-3-pyridinyl)methoxy)-4-chloro-2-(3,4-dichlorophenyl)- is 458.89438 g/mol.
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