TL;DR: 1-Chloropyrido[3,4-d]pyridazine (CAS 162022-92-6) is a chemical compound with molecular formula C7H4ClN3 and molecular weight 165.00937 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloropyrido[3,4-d]pyridazine
Also Known As: 1-chloropyrido[3,4-d]pyridazine, 1-Chloropyrido(3,4-d)pyridazine, 1-Chloro-pyrido(3,4-d)pyridazine, Pyrido[3,4-d]pyridazine, 1-chloro-, Pyrido[3,4-d]pyridazine,1-chloro-
| Molecular Formula | C7H4ClN3 |
| Molecular Weight | 165.00937 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 165.00937 Da |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
| SMILES | C1=CN=CC2=CN=NC(=C21)Cl |
| InChIKey | VSDYJUAGXAHWBC-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloropyrido[3,4-d]pyridazine. With a topological polar surface area (TPSA) of 38.7 Ų, 1-Chloropyrido[3,4-d]pyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloropyrido[3,4-d]pyridazine has 0 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 1-Chloropyrido[3,4-d]pyridazine is 162022-92-6.
The molecular formula of 1-Chloropyrido[3,4-d]pyridazine is C7H4ClN3.
The molecular weight of 1-Chloropyrido[3,4-d]pyridazine is 165.00937 g/mol.
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