N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine
TL;DR: N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine (CAS 774554-22-2) is a chemical compound with molecular formula C17H20ClNO2 and molecular weight 305.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-1-phenylethanamine
Also Known As: N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine, 3-Chloro-4,5-dimethoxy-N-(1-phenylethyl)benzenemethanamine, AN-465/42519154, N-(3-chloro-4,5-dimethoxybenzyl)-1-phenylethanamine, N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-1-phenylethanamine
| Molecular Formula | C17H20ClNO2 |
|---|---|
| Molecular Weight | 305.12 g/mol |
| LogP | 4.208 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 305.11826 |
| Heavy Atoms | 21 |
| Complexity | 586.844 |
Chemical Identifiers
| CAS Number | 774554-22-2 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NCC2=CC(=C(C(=C2)Cl)OC)OC |
Product Overview
N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine (CAS 774554-22-2), with molecular formula C17H20ClNO2 and molecular weight 305.12 g/mol. IUPAC: N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-1-phenylethanamine.
Chemical Property Profile of N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine
Property Insights of N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine
The XLogP value of 4.208 indicates that N-(3-chloro-4,5-dimethoxybenzyl)-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 30.49 Ų, N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine 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-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine?
The CAS number of N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine is 774554-22-2.
What is the molecular formula of N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine?
The molecular formula of N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine is C17H20ClNO2.
What is the molecular weight of N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine?
The molecular weight of N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine is 305.12 g/mol.
Where can I buy N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine?
You can request a quote for N-(3-chloro-4,5-dimethoxybenzyl)-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-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4,5-dimethoxybenzyl)-N-(1-phenylethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.