1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one
TL;DR: 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one (CAS 2560-31-8) is a chemical compound with molecular formula C14H19FN2O and molecular weight 250.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-piperazin-1-ylbutan-1-one
Also Known As: N-Despyridylazaperone, TimTec1_000033, 1-(4-fluorophenyl)-4-(piperazin-1-yl)butan-1-one, 1-(4-FLUORO-PHENYL)-4-PIPERAZIN-1-YL-BUTAN-1-ONE, 1-(4-fluorophenyl)-4-piperazin-1-ylbutan-1-one
| Molecular Formula | C14H19FN2O |
|---|---|
| Molecular Weight | 250.15 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.14815 |
| Heavy Atoms | 18 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 2560-31-8 |
|---|---|
| SMILES | C1CN(CCN1)CCCC(=O)C2=CC=C(C=C2)F |
| InChIKey | POWKNAVDGFNMSG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one (CAS 2560-31-8), with molecular formula C14H19FN2O and molecular weight 250.15 g/mol. IUPAC: 1-(4-fluorophenyl)-4-piperazin-1-ylbutan-1-one.
Chemical Property Profile of 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one
Property Insights of 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one. With a topological polar surface area (TPSA) of 32.3 Ų, 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one has 1 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 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one?
The CAS number of 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one is 2560-31-8.
What is the molecular formula of 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one?
The molecular formula of 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one is C14H19FN2O.
What is the molecular weight of 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one?
The molecular weight of 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one is 250.15 g/mol.
Where can I buy 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one?
You can request a quote for 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorophenyl)-4-(piperazin-1-yl)butan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.