Piperazin-4-ylacetophenone
TL;DR: Piperazin-4-ylacetophenone (CAS 51639-48-6) is a chemical compound with molecular formula C12H16N2O and molecular weight 204.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-piperazin-1-ylphenyl)ethanone
Also Known As: 1-(4-acetylphenyl)piperazine, 1-(4-(piperazin-1-yl)phenyl)ethanone, 4'-Piperazinoacetophenone, 1-(4-piperazin-1-ylphenyl)ethanone, 4-piperazinoacetophenone
| Molecular Formula | C12H16N2O |
|---|---|
| Molecular Weight | 204.13 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.12627 |
| Heavy Atoms | 15 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 51639-48-6 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)N2CCNCC2 |
| InChIKey | KPXVKKBJROCIJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piperazin-4-ylacetophenone (CAS 51639-48-6), with molecular formula C12H16N2O and molecular weight 204.13 g/mol. IUPAC: 1-(4-piperazin-1-ylphenyl)ethanone.
Chemical Property Profile of Piperazin-4-ylacetophenone
Property Insights of Piperazin-4-ylacetophenone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazin-4-ylacetophenone. With a topological polar surface area (TPSA) of 32.3 Ų, Piperazin-4-ylacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazin-4-ylacetophenone has 1 hydrogen bond donor(s) and 3 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 Piperazin-4-ylacetophenone?
The CAS number of Piperazin-4-ylacetophenone is 51639-48-6.
What is the molecular formula of Piperazin-4-ylacetophenone?
The molecular formula of Piperazin-4-ylacetophenone is C12H16N2O.
What is the molecular weight of Piperazin-4-ylacetophenone?
The molecular weight of Piperazin-4-ylacetophenone is 204.13 g/mol.
Where can I buy Piperazin-4-ylacetophenone?
You can request a quote for Piperazin-4-ylacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazin-4-ylacetophenone?
Yes, KEHONG BIO provides custom synthesis services for Piperazin-4-ylacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.