2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone
TL;DR: 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone (CAS 658046-19-6) is a chemical compound with molecular formula C13H15BrClNO2 and molecular weight 331.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-bromo-4-chlorophenoxy)-1-piperidin-1-ylethanone
Also Known As: A1-49254, 2-(2-bromo-4-chlorophenoxy)-1-piperidin-1-ylethanone, 2-(2-bromo-4-chloro-phenoxy)-1-(1-piperidyl)ethanone, 2-(2-BROMO-4-CHLOROPHENOXY)-1-(PIPERIDIN-1-YL)ETHANONE, 2-(2-bromo-4-chlorophenoxy)-1-(piperidin-1-yl)ethan-1-one
| Molecular Formula | C13H15BrClNO2 |
|---|---|
| Molecular Weight | 331.00 g/mol |
| LogP | 3.4938 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.99747 |
| Heavy Atoms | 18 |
| Complexity | 432.99945 |
Chemical Identifiers
| CAS Number | 658046-19-6 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)COC2=C(C=C(C=C2)Cl)Br |
Product Overview
2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone (CAS 658046-19-6), with molecular formula C13H15BrClNO2 and molecular weight 331.00 g/mol. IUPAC: 2-(2-bromo-4-chlorophenoxy)-1-piperidin-1-ylethanone.
Chemical Property Profile of 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone
Property Insights of 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone
The XLogP value of 3.4938 indicates that 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone 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 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone?
The CAS number of 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone is 658046-19-6.
What is the molecular formula of 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone?
The molecular formula of 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone is C13H15BrClNO2.
What is the molecular weight of 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone?
The molecular weight of 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone is 331.00 g/mol.
Where can I buy 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone?
You can request a quote for 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Bromo-4-chlorophenoxy)-1-(piperidin-1-YL)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.