![(2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine structure](/static/products/5963/5963-80-4.webp)
(2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine
TL;DR: (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine (CAS 5963-80-4) 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-[(3,4-dimethoxyphenyl)methyl]-N-[(2-ethoxyphenyl)methyl]ethanamine
Also Known As: BAS 02500839, BIM-0039374.P001, (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine, 2-(1,3-benzodioxol-5-yl)-N-[(3,4-dimethoxyphenyl)methyl]-N-[(2-ethoxyphenyl)methyl]ethanamine, [2-(2H-1,3-BENZODIOXOL-5-YL)ETHYL][(3,4-DIMETHOXYPHENYL)METHYL][(2-ETHOXYPHENYL)METHYL]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 | 1068.1274 |
Chemical Identifiers
| CAS Number | 5963-80-4 |
|---|---|
| SMILES | CCOC1=CC=CC=C1CN(CCC2=CC3=C(C=C2)OCO3)CC4=CC(=C(C=C4)OC)OC |
Product Overview
(2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine (CAS 5963-80-4), with molecular formula C27H31NO5 and molecular weight 449.22 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[(3,4-dimethoxyphenyl)methyl]-N-[(2-ethoxyphenyl)methyl]ethanamine.
Chemical Property Profile of (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine
Property Insights of (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine
The XLogP value of 5.0761 indicates that (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine 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-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine 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-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine?
The CAS number of (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine is 5963-80-4.
What is the molecular formula of (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine?
The molecular formula of (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine is C27H31NO5.
What is the molecular weight of (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine?
The molecular weight of (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine is 449.22 g/mol.
Where can I buy (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine?
You can request a quote for (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine?
Yes, KEHONG BIO provides custom synthesis services for (2-Benzo[1,3]dioxol-5-yl-ethyl)-(3,4-dimethoxy-benzyl)-(2-ethoxy-benzyl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.