TL;DR: Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide (CAS 126661-39-0) is a chemical compound with molecular formula C28H54I2N4O2 and molecular weight 732.23364 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(1-hexylpiperidine-3-carbonyl)piperazin-1-yl]-(1-hexylpiperidin-3-yl)methanone;dihydroiodide
Also Known As: BPAT-143 dihydriodide, N,N'-Bis(1-hexylnipecotoyl)piperazine dihydriodide, 1,4-Bis((1-hexyl-3-piperidinyl)carbonyl)piperazine dihydriodide, Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide, (Piperazine-1,4-diyl)bis[(1-hexylpiperidin-3-yl)methanone]--hydrogen iodide (1/2)
| Molecular Formula | C28H54I2N4O2 |
| Molecular Weight | 732.23364 g/mol |
| XLogP | 5.4778 |
| Topological Polar Surface Area (TPSA) | 47.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 732.23364 Da |
| Heavy Atoms | 36 |
| Complexity | 553.0 |
| SMILES | CCCCCCN1CCCC(C1)C(=O)N2CCN(CC2)C(=O)C3CCCN(C3)CCCCCC.I.I |
| InChIKey | VHPUUFGOMDPWRY-UHFFFAOYSA-N |
The XLogP value of 5.4778 indicates that Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.1 Ų, Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide is 126661-39-0.
The molecular formula of Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide is C28H54I2N4O2.
The molecular weight of Piperazine, 1,4-bis((1-hexyl-3-piperidinyl)carbonyl)-, dihydriodide is 732.23364 g/mol.
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