N-(3-bromo-4-methoxybenzyl)-3-methylaniline
TL;DR: N-(3-bromo-4-methoxybenzyl)-3-methylaniline (CAS 354538-00-4) is a chemical compound with molecular formula C15H16BrNO and molecular weight 305.04 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-methylaniline
Also Known As: N-(3-bromo-4-methoxybenzyl)-3-methylaniline, N-[(3-bromo-4-methoxyphenyl)methyl]-3-methylaniline, BIM-0020224.P001, [(3-bromo-4-methoxyphenyl)methyl](3-methylphenyl)amine, N-(3-BROMO-4-METHOXYBENZYL)-N-(3-METHYLPHENYL)AMINE
| Molecular Formula | C15H16BrNO |
|---|---|
| Molecular Weight | 305.04 g/mol |
| LogP | 4.37822 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.04153 |
| Heavy Atoms | 18 |
| Complexity | 539.76685 |
Chemical Identifiers
| CAS Number | 354538-00-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NCC2=CC(=C(C=C2)OC)Br |
Product Overview
N-(3-bromo-4-methoxybenzyl)-3-methylaniline (CAS 354538-00-4), with molecular formula C15H16BrNO and molecular weight 305.04 g/mol. IUPAC: N-[(3-bromo-4-methoxyphenyl)methyl]-3-methylaniline.
Chemical Property Profile of N-(3-bromo-4-methoxybenzyl)-3-methylaniline
Property Insights of N-(3-bromo-4-methoxybenzyl)-3-methylaniline
The XLogP value of 4.37822 indicates that N-(3-bromo-4-methoxybenzyl)-3-methylaniline 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-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-bromo-4-methoxybenzyl)-3-methylaniline 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-methylaniline?
The CAS number of N-(3-bromo-4-methoxybenzyl)-3-methylaniline is 354538-00-4.
What is the molecular formula of N-(3-bromo-4-methoxybenzyl)-3-methylaniline?
The molecular formula of N-(3-bromo-4-methoxybenzyl)-3-methylaniline is C15H16BrNO.
What is the molecular weight of N-(3-bromo-4-methoxybenzyl)-3-methylaniline?
The molecular weight of N-(3-bromo-4-methoxybenzyl)-3-methylaniline is 305.04 g/mol.
Where can I buy N-(3-bromo-4-methoxybenzyl)-3-methylaniline?
You can request a quote for N-(3-bromo-4-methoxybenzyl)-3-methylaniline 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-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-methoxybenzyl)-3-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.