N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine
TL;DR: N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine (CAS 774555-16-7) is a chemical compound with molecular formula C18H21BrFNO2 and molecular weight 381.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]-2-(2-fluorophenyl)ethanamine
Also Known As: AP-970/42836637, N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine, N-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]-2-(2-fluorophenyl)ethanamine, (3-Bromo-4-ethoxy-5-methoxy-benzyl)-[2-(2-fluoro-phenyl)-ethyl]-amine
| Molecular Formula | C18H21BrFNO2 |
|---|---|
| Molecular Weight | 381.07 g/mol |
| LogP | 4.3278 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 381.07397 |
| Heavy Atoms | 23 |
| Complexity | 648.9139 |
Chemical Identifiers
| CAS Number | 774555-16-7 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1Br)CNCCC2=CC=CC=C2F)OC |
Product Overview
N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine (CAS 774555-16-7), with molecular formula C18H21BrFNO2 and molecular weight 381.07 g/mol. IUPAC: N-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]-2-(2-fluorophenyl)ethanamine.
Chemical Property Profile of N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine
Property Insights of N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine
The XLogP value of 4.3278 indicates that N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)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-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)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-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine?
The CAS number of N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine is 774555-16-7.
What is the molecular formula of N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine?
The molecular formula of N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine is C18H21BrFNO2.
What is the molecular weight of N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine?
The molecular weight of N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine is 381.07 g/mol.
Where can I buy N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine?
You can request a quote for N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-ethoxy-5-methoxybenzyl)-2-(2-fluorophenyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.