1-(4-Bromophenyl)-2-piperidin-1-ylethanone
TL;DR: 1-(4-Bromophenyl)-2-piperidin-1-ylethanone (CAS 111022-38-9) is a chemical compound with molecular formula C13H16BrNO and molecular weight 281.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-2-piperidin-1-ylethanone
Also Known As: 1-(4-bromophenyl)-2-piperidin-1-ylethanone, 1-(4-bromophenyl)-2-(piperidin-1-yl)ethan-1-one
| Molecular Formula | C13H16BrNO |
|---|---|
| Molecular Weight | 281.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.04153 |
| Heavy Atoms | 16 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 111022-38-9 |
|---|---|
| SMILES | C1CCN(CC1)CC(=O)C2=CC=C(C=C2)Br |
| InChIKey | HFWAWINHWRYYPY-UHFFFAOYSA-N |
Product Overview
1-(4-Bromophenyl)-2-piperidin-1-ylethanone (CAS 111022-38-9), with molecular formula C13H16BrNO and molecular weight 281.04 g/mol. IUPAC: 1-(4-bromophenyl)-2-piperidin-1-ylethanone.
Chemical Property Profile of 1-(4-Bromophenyl)-2-piperidin-1-ylethanone
Property Insights of 1-(4-Bromophenyl)-2-piperidin-1-ylethanone
The XLogP value of 3.2 indicates that 1-(4-Bromophenyl)-2-piperidin-1-ylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(4-Bromophenyl)-2-piperidin-1-ylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-2-piperidin-1-ylethanone 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-Bromophenyl)-2-piperidin-1-ylethanone?
The CAS number of 1-(4-Bromophenyl)-2-piperidin-1-ylethanone is 111022-38-9.
What is the molecular formula of 1-(4-Bromophenyl)-2-piperidin-1-ylethanone?
The molecular formula of 1-(4-Bromophenyl)-2-piperidin-1-ylethanone is C13H16BrNO.
What is the molecular weight of 1-(4-Bromophenyl)-2-piperidin-1-ylethanone?
The molecular weight of 1-(4-Bromophenyl)-2-piperidin-1-ylethanone is 281.04 g/mol.
Where can I buy 1-(4-Bromophenyl)-2-piperidin-1-ylethanone?
You can request a quote for 1-(4-Bromophenyl)-2-piperidin-1-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromophenyl)-2-piperidin-1-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenyl)-2-piperidin-1-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.