2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate
TL;DR: 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate (CAS 860614-72-8) is a chemical compound with molecular formula C22H29NO3 and molecular weight 355.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzyl(methyl)amino]ethyl 2-(4-tert-butylphenoxy)acetate
Also Known As: AO-365/41272862, 2-[benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate, 2-(benzyl(methyl)amino)ethyl 2-(4-(tert-butyl)phenoxy)acetate, 2-[benzyl(methyl)amino]ethyl 2-(4-tert-butylphenoxy)acetate
| Molecular Formula | C22H29NO3 |
|---|---|
| Molecular Weight | 355.21 g/mol |
| LogP | 4.0381 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 355.21475 |
| Heavy Atoms | 26 |
| Complexity | 674.78357 |
Chemical Identifiers
| CAS Number | 860614-72-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OCC(=O)OCCN(C)CC2=CC=CC=C2 |
Product Overview
2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate (CAS 860614-72-8), with molecular formula C22H29NO3 and molecular weight 355.21 g/mol. IUPAC: 2-[benzyl(methyl)amino]ethyl 2-(4-tert-butylphenoxy)acetate.
Chemical Property Profile of 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate
Property Insights of 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate
The XLogP value of 4.0381 indicates that 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate has 0 hydrogen bond donor(s) and 4 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-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate?
The CAS number of 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate is 860614-72-8.
What is the molecular formula of 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate?
The molecular formula of 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate is C22H29NO3.
What is the molecular weight of 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate?
The molecular weight of 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate is 355.21 g/mol.
Where can I buy 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate?
You can request a quote for 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-[Benzyl(methyl)amino]ethyl (4-tert-butylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.