TL;DR: Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl- (CAS 101975-82-0) is a chemical compound with molecular formula C23H40N2 and molecular weight 344.31915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-adamantylmethyl)-4-cyclooctylpiperazine
Also Known As: N'-(1-Adamantylmethyl)-N-cyclooctylpiperazine, Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl-, 1-(1-adamantylmethyl)-4-cyclooctylpiperazine, 1-Cyclooctyl-4-(1-adamantylmethyl)piperazine, 1-cyclooctyl-4-{[(3r)-adamantan-1-yl]methyl}piperazine
| Molecular Formula | C23H40N2 |
| Molecular Weight | 344.31915 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.31915 Da |
| Heavy Atoms | 25 |
| Complexity | 402.0 |
| SMILES | C1CCCC(CCC1)N2CCN(CC2)CC34CC5CC(C3)CC(C5)C4 |
| InChIKey | KHUSQSXJKGFLFB-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl- is 101975-82-0.
The molecular formula of Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl- is C23H40N2.
The molecular weight of Piperazine, 4-(1-adamantylmethyl)-1-cyclooctyl- is 344.31915 g/mol.
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