N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine
TL;DR: N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine (CAS 13159-76-7) is a chemical compound with molecular formula C15H16ClNO2 and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(3,4-dimethoxyphenyl)methyl]aniline
Also Known As: 4-chloro-N-(3,4-dimethoxybenzyl)aniline, 4-chloro-N-[(3,4-dimethoxyphenyl)methyl]aniline, N-(3,4-Dimethoxybenzyl)-4-chloroaniline, N-(4-CHLOROPHENYL)-3,4-DIMETHOXYBENZYLAMINE, AN-465/42191442
| Molecular Formula | C15H16ClNO2 |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 3.9693 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.08694 |
| Heavy Atoms | 19 |
| Complexity | 540.34186 |
Chemical Identifiers
| CAS Number | 13159-76-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CNC2=CC=C(C=C2)Cl)OC |
Product Overview
N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine (CAS 13159-76-7), with molecular formula C15H16ClNO2 and molecular weight 277.09 g/mol. IUPAC: 4-chloro-N-[(3,4-dimethoxyphenyl)methyl]aniline.
Chemical Property Profile of N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine
Property Insights of N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine
The XLogP value of 3.9693 indicates that N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine 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-(4-Chlorophenyl)-3,4-dimethoxybenzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine 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-(4-Chlorophenyl)-3,4-dimethoxybenzylamine?
The CAS number of N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine is 13159-76-7.
What is the molecular formula of N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine?
The molecular formula of N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine is C15H16ClNO2.
What is the molecular weight of N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine?
The molecular weight of N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine is 277.09 g/mol.
Where can I buy N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine?
You can request a quote for N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chlorophenyl)-3,4-dimethoxybenzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.