[1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop
TL;DR: [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop (CAS 7474-26-2) is a chemical compound with molecular formula C21H25N3O8 and molecular weight 447.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylpropyl] 3,5-dinitrobenzoate
Also Known As: [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop|[1-(2-dimethylaminoethyloxy)-2-hydroxy-2-methyl-1-phenylpropyl] 3,5-dinitrobenzoate|[1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylpropyl] 3,5-dinitrobenzoate|1-[2-(Dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylpropyl 3,5-dinitrobenzoate
| Molecular Formula | C21H25N3O8 |
|---|---|
| Molecular Weight | 447.16 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 447.16415 |
| Heavy Atoms | 32 |
| Complexity | 647.0 |
Chemical Identifiers
| CAS Number | 7474-26-2 |
|---|---|
| SMILES | CC(C)(C(C1=CC=CC=C1)(OCCN(C)C)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O |
| InChIKey | YWOBPUMZMRYMEB-UHFFFAOYSA-N |
Product Overview
[1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop (CAS 7474-26-2), with molecular formula C21H25N3O8 and molecular weight 447.16 g/mol. IUPAC: [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylpropyl] 3,5-dinitrobenzoate.
Chemical Property Profile of [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop
Property Insights of [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop. The TPSA of 151.0 Ų indicates high polarity, suggesting [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop has 1 hydrogen bond donor(s) and 9 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 [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop?
The CAS number of [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop is 7474-26-2.
What is the molecular formula of [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop?
The molecular formula of [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop is C21H25N3O8.
What is the molecular weight of [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop?
The molecular weight of [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop is 447.16 g/mol.
Where can I buy [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop?
You can request a quote for [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop?
Yes, KEHONG BIO provides custom synthesis services for [1-[2-(dimethylamino)ethoxy]-2-hydroxy-2-methyl-1-phenylprop and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.