N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine
TL;DR: N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine (CAS 712348-77-1) is a chemical compound with molecular formula C16H18BrNO and molecular weight 319.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromo-4-methoxyphenyl)methyl]-1-phenylethanamine
Also Known As: N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine, 3-Bromo-4-methoxy-N-(1-phenylethyl)benzenemethanamine, AN-465/42889267, N-[(3-bromo-4-methoxyphenyl)methyl]-1-phenylethanamine, [(3-bromo-4-methoxyphenyl)methyl](phenylethyl)amine
| Molecular Formula | C16H18BrNO |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 4.3085 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.0572 |
| Heavy Atoms | 19 |
| Complexity | 527.5271 |
Chemical Identifiers
| CAS Number | 712348-77-1 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NCC2=CC(=C(C=C2)OC)Br |
Product Overview
N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine (CAS 712348-77-1), with molecular formula C16H18BrNO and molecular weight 319.06 g/mol. IUPAC: N-[(3-bromo-4-methoxyphenyl)methyl]-1-phenylethanamine.
Chemical Property Profile of N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine
Property Insights of N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine
The XLogP value of 4.3085 indicates that N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)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-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)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-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine?
The CAS number of N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine is 712348-77-1.
What is the molecular formula of N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine?
The molecular formula of N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine is C16H18BrNO.
What is the molecular weight of N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine?
The molecular weight of N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine is 319.06 g/mol.
Where can I buy N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine?
You can request a quote for N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine 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-methoxybenzyl)-N-(1-phenylethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-methoxybenzyl)-N-(1-phenylethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.