TL;DR: 4-(Chloropropyl)-1-(2-quinolyl)piperazine (CAS 111035-53-1) is a chemical compound with molecular formula C16H20ClN3 and molecular weight 289.13458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(3-chloropropyl)piperazin-1-yl]quinoline
Also Known As: 4- -1- piperazine, AAL 13, a-al13, 4-(Chloropropyl)-1-(2-quinolyl)piperazine, 4-CPQP
| Molecular Formula | C16H20ClN3 |
| Molecular Weight | 289.13458 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 19.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.13458 Da |
| Heavy Atoms | 20 |
| Complexity | 291.0 |
| SMILES | C1CN(CCN1CCCCl)C2=NC3=CC=CC=C3C=C2 |
| InChIKey | SABCCZAHTZTCNO-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 4-(Chloropropyl)-1-(2-quinolyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.4 Ų, 4-(Chloropropyl)-1-(2-quinolyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Chloropropyl)-1-(2-quinolyl)piperazine 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 4-(Chloropropyl)-1-(2-quinolyl)piperazine is 111035-53-1.
The molecular formula of 4-(Chloropropyl)-1-(2-quinolyl)piperazine is C16H20ClN3.
The molecular weight of 4-(Chloropropyl)-1-(2-quinolyl)piperazine is 289.13458 g/mol.
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