N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine
TL;DR: N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine (CAS 774555-11-2) is a chemical compound with molecular formula C16H17ClFNO and molecular weight 293.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-chloro-2-ethoxyphenyl)methyl]-1-(4-fluorophenyl)methanamine
Also Known As: N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine, AN-465/42767232, 5-Chloro-2-ethoxy-N-[(4-fluorophenyl)methyl]benzenemethanamine, N-[(5-chloro-2-ethoxyphenyl)methyl]-1-(4-fluorophenyl)methanamine
| Molecular Formula | C16H17ClFNO |
|---|---|
| Molecular Weight | 293.10 g/mol |
| LogP | 4.1676 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 293.09827 |
| Heavy Atoms | 20 |
| Complexity | 556.9034 |
Chemical Identifiers
| CAS Number | 774555-11-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)Cl)CNCC2=CC=C(C=C2)F |
Product Overview
N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine (CAS 774555-11-2), with molecular formula C16H17ClFNO and molecular weight 293.10 g/mol. IUPAC: N-[(5-chloro-2-ethoxyphenyl)methyl]-1-(4-fluorophenyl)methanamine.
Chemical Property Profile of N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine
Property Insights of N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine
The XLogP value of 4.1676 indicates that N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine has 1 hydrogen bond donor(s) and 2 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-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine?
The CAS number of N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine is 774555-11-2.
What is the molecular formula of N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine?
The molecular formula of N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine is C16H17ClFNO.
What is the molecular weight of N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine?
The molecular weight of N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine is 293.10 g/mol.
Where can I buy N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine?
You can request a quote for N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine?
Yes, KEHONG BIO provides custom synthesis services for N-(5-chloro-2-ethoxybenzyl)-N-(4-fluorobenzyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.