TL;DR: 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride (CAS 125849-26-5) is a chemical compound with molecular formula C21H30Cl2N2O2 and molecular weight 412.16843 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-[2-(2-phenylphenoxy)ethyl]piperazin-1-yl]propan-1-ol;dihydrochloride
Also Known As: 3-(4-(2-(2-Biphenylyloxy)ethyl)-1-piperazinyl)propanol dihydrochloride, 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride, 4-(2-((1,1'-Biphenyl)-2-yloxy)ethyl)-1-piperazinepropanol dihydrochloride, 3-[4-[2-(2-phenylphenoxy)ethyl]piperazin-1-yl]propan-1-ol dihydrochloride, 3-[4-[2-(2-phenylphenoxy)ethyl]piperazin-1-yl]propan-1-ol,dihydrochloride
| Molecular Formula | C21H30Cl2N2O2 |
| Molecular Weight | 412.16843 g/mol |
| XLogP | 3.576 |
| Topological Polar Surface Area (TPSA) | 35.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.16843 Da |
| Heavy Atoms | 27 |
| Complexity | 352.0 |
| SMILES | C1CN(CCN1CCCO)CCOC2=CC=CC=C2C3=CC=CC=C3.Cl.Cl |
| InChIKey | RRXOCNXJCFPVSG-UHFFFAOYSA-N |
The XLogP value of 3.576 indicates that 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride has 3 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 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride is 125849-26-5.
The molecular formula of 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride is C21H30Cl2N2O2.
The molecular weight of 1-Piperazinepropanol, 4-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-, dihydrochloride is 412.16843 g/mol.
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