2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine
TL;DR: 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine (CAS 353779-13-2) is a chemical compound with molecular formula C27H31NO5 and molecular weight 449.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-N-[(3,5-dimethoxyphenyl)methyl]-N-[(4-ethoxyphenyl)methyl]ethanamine
Also Known As: BAS 01313373, 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine, [2-(2H-1,3-BENZODIOXOL-5-YL)ETHYL][(3,5-DIMETHOXYPHENYL)METHYL][(4-ETHOXYPHENYL)METHYL]AMINE, 2-(1,3-benzodioxol-5-yl)-N-[(3,5-dimethoxyphenyl)methyl]-N-[(4-ethoxyphenyl)methyl]ethanamine, (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,5-dimethoxy-benzyl)-(4-ethoxy-benzyl)-amine
| Molecular Formula | C27H31NO5 |
|---|---|
| Molecular Weight | 449.22 g/mol |
| LogP | 5.0761 |
| Topological Polar Surface Area | 49.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 449.2202 |
| Heavy Atoms | 33 |
| Complexity | 1028.6274 |
Chemical Identifiers
| CAS Number | 353779-13-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CN(CCC2=CC3=C(C=C2)OCO3)CC4=CC(=CC(=C4)OC)OC |
Product Overview
2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine (CAS 353779-13-2), with molecular formula C27H31NO5 and molecular weight 449.22 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[(3,5-dimethoxyphenyl)methyl]-N-[(4-ethoxyphenyl)methyl]ethanamine.
Chemical Property Profile of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine
Property Insights of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine
The XLogP value of 5.0761 indicates that 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.39 Ų, 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine?
The CAS number of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine is 353779-13-2.
What is the molecular formula of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine?
The molecular formula of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine is C27H31NO5.
What is the molecular weight of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine?
The molecular weight of 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine is 449.22 g/mol.
Where can I buy 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine?
You can request a quote for 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzodioxol-5-yl)-N-(3,5-dimethoxybenzyl)-N-(4-ethoxybenzyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.