TL;DR: Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)- (CAS 18128-25-1) is a chemical compound with molecular formula C25H29N and molecular weight 343.23 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-(1-adamantyl)-10,12-dihydro-5H-benzo[d][2]benzazocine
Also Known As: Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)-, 5,6,7,12-Tetrahydro-6-(1-adamantyl)dibenz(c,f)azocine, Dibenz(c,f)azocine, 6-(1-adamantyl)-5,6,7,12-tetrahydro-, 11-(1-adamantyl)-10,12-dihydro-5H-benzo[d][2]benzazocine, 6-(Adamantan-1-yl)-5,6,7,12-tetrahydrodibenzo[c,f]azocine
| Molecular Formula | C25H29N |
| Molecular Weight | 343.23 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.23 Da |
| Heavy Atoms | 26 |
| Complexity | 459.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)N4CC5=CC=CC=C5CC6=CC=CC=C6C4 |
| InChIKey | CCFPDWPNHCCJCO-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)- is 18128-25-1.
The molecular formula of Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)- is C25H29N.
The molecular weight of Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)- is 343.23 g/mol.
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