N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate
TL;DR: N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate (CAS 67338-56-1) is a chemical compound with molecular formula C27H39NO6 and molecular weight 473.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-(4-methoxyphenyl)propan-2-yl-propylamino]butyl 3,4,5-trimethoxybenzoate
Also Known As: N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate, Phenethylamine, N-(4-hydroxybutyl)-4-methoxy-alpha-methyl-N-propyl-, 3,4,5-trimethoxybenzoate (ester), 4-{[1-(4-Methoxyphenyl)propan-2-yl](propyl)amino}butyl 3,4,5-trimethoxybenzoate, 3,4,5-Trimethoxybenzoic acid 4-[(4-methoxy-alpha-methylphenethyl)propylamino]butyl ester, 4-[1-(4-methoxyphenyl)propan-2-yl-propylamino]butyl 3,4,5-trimethoxybenzoate
| Molecular Formula | C27H39NO6 |
|---|---|
| Molecular Weight | 473.28 g/mol |
| LogP | 5.0012 |
| Topological Polar Surface Area | 66.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 473.27774 |
| Heavy Atoms | 34 |
| Complexity | 858.1842 |
Chemical Identifiers
| CAS Number | 67338-56-1 |
|---|---|
| SMILES | CCCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)C(C)CC2=CC=C(C=C2)OC |
Product Overview
N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate (CAS 67338-56-1), with molecular formula C27H39NO6 and molecular weight 473.28 g/mol. IUPAC: 4-[1-(4-methoxyphenyl)propan-2-yl-propylamino]butyl 3,4,5-trimethoxybenzoate.
Chemical Property Profile of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate
Property Insights of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate
The XLogP value of 5.0012 indicates that N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.46 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate?
The CAS number of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate is 67338-56-1.
What is the molecular formula of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate?
The molecular formula of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate is C27H39NO6.
What is the molecular weight of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate?
The molecular weight of N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate is 473.28 g/mol.
Where can I buy N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate?
You can request a quote for N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Hydroxybutyl)-4-methoxy-alpha-methyl-N-propylphenethylamine 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.