1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine
TL;DR: 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine (CAS 302949-67-3) is a chemical compound with molecular formula C17H24BrNO2 and molecular weight 353.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-2-tert-butylphenoxy)-1-piperidin-1-ylethanone
Also Known As: 1-[(4-bromo-2-tert-butylphenoxy)acetyl]piperidine, AP-906/09598018, 2-[4-Bromo-2-(1,1-dimethylethyl)phenoxy]-1-(1-piperidinyl)ethanone, 2-(4-bromo-2-tert-butylphenoxy)-1-piperidin-1-ylethanone, 2-[2-(tert-butyl)-4-bromophenoxy]-1-piperidylethan-1-one
| Molecular Formula | C17H24BrNO2 |
|---|---|
| Molecular Weight | 353.10 g/mol |
| LogP | 4.1379 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.09903 |
| Heavy Atoms | 21 |
| Complexity | 502.00183 |
Chemical Identifiers
| CAS Number | 302949-67-3 |
|---|---|
| SMILES | CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)N2CCCCC2 |
Product Overview
1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine (CAS 302949-67-3), with molecular formula C17H24BrNO2 and molecular weight 353.10 g/mol. IUPAC: 2-(4-bromo-2-tert-butylphenoxy)-1-piperidin-1-ylethanone.
Chemical Property Profile of 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine
Property Insights of 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine
The XLogP value of 4.1379 indicates that 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine has 0 hydrogen bond donor(s) and 2 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-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine?
The CAS number of 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine is 302949-67-3.
What is the molecular formula of 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine?
The molecular formula of 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine is C17H24BrNO2.
What is the molecular weight of 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine?
The molecular weight of 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine is 353.10 g/mol.
Where can I buy 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine?
You can request a quote for 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Bromo-2-tert-butylphenoxy)acetyl]piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.