1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate
TL;DR: 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate (CAS 126661-20-9) is a chemical compound with molecular formula C34H40N2O9 and molecular weight 620.2734 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-but-2-enedioic acid;1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[2-[2-[4-(dimethylamino)phenyl]ethynyl]-5-methoxyphenoxy]propan-2-ol
Also Known As: 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate, (E)-but-2-enedioic acid; 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[2-[2-(4-dimethylaminophenyl)ethynyl]-5-methoxyphenoxy]propan-2-ol
Technical Specifications
| Molecular Formula | C34H40N2O9 |
| Molecular Weight | 620.2734 g/mol |
| XLogP | 3.462 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 16 |
| Exact Mass | 620.2734 Da |
| Heavy Atoms | 45 |
| Complexity | 818.0 |
| SMILES | CN(C)C1=CC=C(C=C1)C#CC2=C(C=C(C=C2)OC)OCC(CNCCC3=CC(=C(C=C3)OC)OC)O.C(=C/C(=O)O)\C(=O)O |
| InChIKey | AZALVRNGWXXLLF-WLHGVMLRSA-N |
Chemical Property Profile of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate
Property Insights of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate
The XLogP value of 3.462 indicates that 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate?
The CAS number of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate is 126661-20-9.
What is the molecular formula of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate?
The molecular formula of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate is C34H40N2O9.
What is the molecular weight of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate?
The molecular weight of 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate is 620.2734 g/mol.
Where can I buy 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate?
You can request a quote for 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate?
Yes, CoreyChem provides custom synthesis services for 1-((2-(3,4-Dimethoxyphenyl)ethyl)amino)-3-(2-((4-(dimethylamino)-phenyl)ethynyl)-5-methoxyphenoxy)-2-propanol fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.