TL;DR: N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride (CAS 1050125-93-3) is a chemical compound with molecular formula C20H19Cl2FN2O and molecular weight 392.08585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-1-pyridin-2-ylmethanamine;hydrochloride
Also Known As: N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride, 1-[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]-N-(pyridin-2-ylmethyl)methanamine Hydrochloride, N-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl]-1-pyridin-2-ylmethanamine hydrochloride
| Molecular Formula | C20H19Cl2FN2O |
| Molecular Weight | 392.08585 g/mol |
| XLogP | 5.1647 |
| Topological Polar Surface Area (TPSA) | 34.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.08585 Da |
| Heavy Atoms | 26 |
| Complexity | 379.0 |
| SMILES | C1=CC=NC(=C1)CNCC2=C(C=CC(=C2)Cl)OCC3=CC=C(C=C3)F.Cl |
| InChIKey | AOTDHXOGIFMGJT-UHFFFAOYSA-N |
The XLogP value of 5.1647 indicates that N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.2 Ų, N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride is 1050125-93-3.
The molecular formula of N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride is C20H19Cl2FN2O.
The molecular weight of N-(5-chloro-2-((4-fluorobenzyl)oxy)benzyl)-1-(pyridin-2-yl)methanamine hydrochloride is 392.08585 g/mol.
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