N-Benzyl-2,4-dimethoxyaniline
TL;DR: N-Benzyl-2,4-dimethoxyaniline (CAS 85775-69-5) is a chemical compound with molecular formula C15H17NO2 and molecular weight 243.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2,4-dimethoxyaniline
Also Known As: N-Benzyl-2,4-dimethoxyaniline, Benzyl-(2,4-dimethoxy-phenyl)-amine, Benzenemethanamine,N-(2,4-dimethoxyphenyl), Benzenemethanamine, N-(2,4-dimethoxyphenyl)-, RefChem:363259
| Molecular Formula | C15H17NO2 |
|---|---|
| Molecular Weight | 243.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.12593 |
| Heavy Atoms | 18 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 85775-69-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NCC2=CC=CC=C2)OC |
| InChIKey | MSRILNUBJHFTQG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Benzyl-2,4-dimethoxyaniline (CAS 85775-69-5), with molecular formula C15H17NO2 and molecular weight 243.13 g/mol. IUPAC: N-benzyl-2,4-dimethoxyaniline.
Chemical Property Profile of N-Benzyl-2,4-dimethoxyaniline
Property Insights of N-Benzyl-2,4-dimethoxyaniline
The XLogP value of 3.3 indicates that N-Benzyl-2,4-dimethoxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.5 Ų, N-Benzyl-2,4-dimethoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyl-2,4-dimethoxyaniline 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-Benzyl-2,4-dimethoxyaniline?
The CAS number of N-Benzyl-2,4-dimethoxyaniline is 85775-69-5.
What is the molecular formula of N-Benzyl-2,4-dimethoxyaniline?
The molecular formula of N-Benzyl-2,4-dimethoxyaniline is C15H17NO2.
What is the molecular weight of N-Benzyl-2,4-dimethoxyaniline?
The molecular weight of N-Benzyl-2,4-dimethoxyaniline is 243.13 g/mol.
Where can I buy N-Benzyl-2,4-dimethoxyaniline?
You can request a quote for N-Benzyl-2,4-dimethoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-2,4-dimethoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-2,4-dimethoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.