TL;DR: 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride (CAS 63716-20-1) is a chemical compound with molecular formula C26H32Cl2N2O3 and molecular weight 490.179 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[1-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-2-yl]propan-1-one;dihydrochloride
Also Known As: 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride, 2'-Propionaphthone, 1'-(2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy)-, dihydrochloride, 1-{1-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-2-naphthyl}propan-1-one dihydrochloride, 1-[1-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-2-yl]propan-1-one dihydrochloride, 1-{1-[2-Hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-2-yl}propan-1-one--hydrogen chloride (1/2)
| Molecular Formula | C26H32Cl2N2O3 |
| Molecular Weight | 490.179 g/mol |
| XLogP | 4.84 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 490.179 Da |
| Heavy Atoms | 33 |
| Complexity | 557.0 |
| SMILES | CCC(=O)C1=C(C2=CC=CC=C2C=C1)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl.Cl |
| InChIKey | ONWYYGBIGCFYRF-UHFFFAOYSA-N |
The XLogP value of 4.84 indicates that 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride is 63716-20-1.
The molecular formula of 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride is C26H32Cl2N2O3.
The molecular weight of 2-Propanol, 1-(4-phenylpiperazinyl)-3-(2-propionylnaphthyloxy)-, dihydrochloride is 490.179 g/mol.
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