N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine
TL;DR: N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine (CAS 861451-96-9) is a chemical compound with molecular formula C17H20FNO2 and molecular weight 289.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]ethanamine
Also Known As: N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine, AN-465/42245922, N-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]ethanamine, N-ethyl-N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}amine, N-[[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]methyl]ethanamine
| Molecular Formula | C17H20FNO2 |
|---|---|
| Molecular Weight | 289.15 g/mol |
| LogP | 3.5228 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 289.1478 |
| Heavy Atoms | 21 |
| Complexity | 569.5028 |
Chemical Identifiers
| CAS Number | 861451-96-9 |
|---|---|
| SMILES | CCNCC1=CC(=C(C=C1)OCC2=CC=C(C=C2)F)OC |
Product Overview
N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine (CAS 861451-96-9), with molecular formula C17H20FNO2 and molecular weight 289.15 g/mol. IUPAC: N-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]ethanamine.
Chemical Property Profile of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine
Property Insights of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine
The XLogP value of 3.5228 indicates that N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine?
The CAS number of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine is 861451-96-9.
What is the molecular formula of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine?
The molecular formula of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine is C17H20FNO2.
What is the molecular weight of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine?
The molecular weight of N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine is 289.15 g/mol.
Where can I buy N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine?
You can request a quote for N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzyl}ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.