TL;DR: RefChem:385973 (CAS 118202-66-7) is a chemical compound with molecular formula C21H34NO4P and molecular weight 395.22253 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(1-adamantyl)ethyl]-1-phenylpropan-2-amine;phosphoric acid
Also Known As: N-(1-(1-Adamantyl)ethyl)-2-phenylisopropylamine phosphate, N-[2-(1-adamantyl)ethyl]-1-phenylpropan-2-amine; phosphoric acid, N-(1-Methyl-2-phenylethyl)tricyclo(3.3.1.1(sup 3,7))decane-1-ethanamine phosphate, Tricyclo(3.3.1.1(sup 3,7))decane-1-ethanamine, N-(1-methyl-2-phenylethyl)-, phosphate (1:1), N-(1-(1-Adamantyl)ethyl)-2-phenylisopropylaminephosphate
| Molecular Formula | C21H34NO4P |
| Molecular Weight | 395.22253 g/mol |
| XLogP | 3.89 |
| Topological Polar Surface Area (TPSA) | 89.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.22253 Da |
| Heavy Atoms | 27 |
| Complexity | 377.0 |
| SMILES | CC(CC1=CC=CC=C1)NCCC23CC4CC(C2)CC(C4)C3.OP(=O)(O)O |
| InChIKey | FIJSYJABOMOSBQ-UHFFFAOYSA-N |
The XLogP value of 3.89 indicates that RefChem:385973 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:385973. Following Lipinski's Rule of Five, RefChem:385973 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:385973 is 118202-66-7.
The molecular formula of RefChem:385973 is C21H34NO4P.
The molecular weight of RefChem:385973 is 395.22253 g/mol.
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