TL;DR: 3-Chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine (CAS 104719-71-3) is a chemical compound with molecular formula C17H19ClN4 and molecular weight 314.12982 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine
Also Known As: Lorcinadol, R 62818
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H19ClN4 |
| Molecular Weight | 314.12982 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.12982 Da |
| Heavy Atoms | 22 |
| Complexity | 349.0 |
| SMILES | C1CN(CCN1CC=CC2=CC=CC=C2)C3=NN=C(C=C3)Cl |
| InChIKey | NCPBMOFVRBEVJY-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 3-Chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 3-Chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine 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-Chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine is 104719-71-3.
The molecular formula of 3-Chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine is C17H19ClN4.
The molecular weight of 3-Chloro-6-[4-(3-phenylprop-2-enyl)piperazin-1-yl]pyridazine is 314.12982 g/mol.
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