TL;DR: 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester) (CAS 121759-24-8) is a chemical compound with molecular formula C26H34N2O4 and molecular weight 438.25186 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[4-(3-acetyloxy-3-phenylpropyl)piperazin-1-yl]-1-phenylpropyl] acetate
Also Known As: alpha,alpha'-Diphenyl-1,4-piperazinedipropanol diacetate (ester), 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester), (Piperazine-1,4-diyl)bis(1-phenylpropane-3,1-diyl) diacetate, [3-[4-(3-acetyloxy-3-phenylpropyl)piperazin-1-yl]-1-phenylpropyl] acetate
| Molecular Formula | C26H34N2O4 |
| Molecular Weight | 438.25186 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 438.25186 Da |
| Heavy Atoms | 32 |
| Complexity | 514.0 |
| SMILES | CC(=O)OC(CCN1CCN(CC1)CCC(C2=CC=CC=C2)OC(=O)C)C3=CC=CC=C3 |
| InChIKey | PQTISKIMRCWTRN-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.1 Ų, 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester) is 121759-24-8.
The molecular formula of 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester) is C26H34N2O4.
The molecular weight of 1,4-Piperazinedipropanol, alpha,alpha'-diphenyl-, diacetate (ester) is 438.25186 g/mol.
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