N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline
TL;DR: N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline (CAS 353779-54-1) 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]-3,4-dimethylaniline
Also Known As: N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline, BAS 01125333, N-[(3-bromo-4-methoxyphenyl)methyl]-3,4-dimethylaniline, AB00087663-01, (3,4-dimethylphenyl)[(3-bromo-4-methoxyphenyl)methyl]amine
| Molecular Formula | C16H18BrNO |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 4.68664 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.0572 |
| Heavy Atoms | 19 |
| Complexity | 580.9568 |
Chemical Identifiers
| CAS Number | 353779-54-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)OC)Br)C |
Product Overview
N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline (CAS 353779-54-1), with molecular formula C16H18BrNO and molecular weight 319.06 g/mol. IUPAC: N-[(3-bromo-4-methoxyphenyl)methyl]-3,4-dimethylaniline.
Chemical Property Profile of N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline
Property Insights of N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline
The XLogP value of 4.68664 indicates that N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline 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)-3,4-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline 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)-3,4-dimethylaniline?
The CAS number of N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline is 353779-54-1.
What is the molecular formula of N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline?
The molecular formula of N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline is C16H18BrNO.
What is the molecular weight of N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline?
The molecular weight of N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline is 319.06 g/mol.
Where can I buy N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline?
You can request a quote for N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline 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)-3,4-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-methoxybenzyl)-3,4-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.