2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene
TL;DR: 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene (CAS 91677-51-9) is a chemical compound with molecular formula C23H25NO5 and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydrobenzo[g][1,4]benzodioxin-3-ylmethyl)-2-(2,6-dimethoxyphenoxy)ethanamine
Also Known As: WB 4101 Naphthodioxane, 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene, N-(2,3-dihydrobenzo[g][1,4]benzodioxin-3-ylmethyl)-2-(2,6-dimethoxyphenoxy)ethanamine, N-[(2,3-Dihydronaphtho[2,3-b][1,4]dioxin-2-yl)methyl]-2-(2,6-dimethoxyphenoxy)ethan-1-amine, Naphtho(2,3-b)-1,4-dioxin-2-methanamine, N-(2-(2,6-dimethoxyphenoxy)ethyl)-2,3-dihydro-, (Z,E,E,E,E)-
| Molecular Formula | C23H25NO5 |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 395.17328 |
| Heavy Atoms | 29 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 91677-51-9 |
|---|---|
| SMILES | COC1=C(C(=CC=C1)OC)OCCNCC2COC3=CC4=CC=CC=C4C=C3O2 |
| InChIKey | DEXRYWBZRATHBC-UHFFFAOYSA-N |
Product Overview
2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene (CAS 91677-51-9), with molecular formula C23H25NO5 and molecular weight 395.17 g/mol. IUPAC: N-(2,3-dihydrobenzo[g][1,4]benzodioxin-3-ylmethyl)-2-(2,6-dimethoxyphenoxy)ethanamine.
Chemical Property Profile of 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene
Property Insights of 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene
The XLogP value of 4.1 indicates that 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene has 1 hydrogen bond donor(s) and 6 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 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene?
The CAS number of 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene is 91677-51-9.
What is the molecular formula of 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene?
The molecular formula of 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene is C23H25NO5.
What is the molecular weight of 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene?
The molecular weight of 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene is 395.17 g/mol.
Where can I buy 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene?
You can request a quote for 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-Ethyl(2,6-dimethoxyphenoxy)amino)methyl)1,4-dioxane-(2,3-b)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.