1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine
TL;DR: 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine (CAS 5979-86-2) is a chemical compound with molecular formula C18H16ClFN2O2 and molecular weight 346.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3-chlorobenzoyl)piperazin-1-yl]-(4-fluorophenyl)methanone
Also Known As: 1-(3-chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine, BIM-0039240.P001, [4-(3-chlorobenzoyl)piperazin-1-yl]-(4-fluorophenyl)methanone, AT-057/43314036, [4-(3-Chlorobenzoyl)piperazin-1-yl](4-fluorophenyl)methanone
| Molecular Formula | C18H16ClFN2O2 |
|---|---|
| Molecular Weight | 346.09 g/mol |
| LogP | 3.0773 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.08844 |
| Heavy Atoms | 24 |
| Complexity | 755.869 |
Chemical Identifiers
| CAS Number | 5979-86-2 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CC=C(C=C2)F)C(=O)C3=CC(=CC=C3)Cl |
Product Overview
1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine (CAS 5979-86-2), with molecular formula C18H16ClFN2O2 and molecular weight 346.09 g/mol. IUPAC: [4-(3-chlorobenzoyl)piperazin-1-yl]-(4-fluorophenyl)methanone.
Chemical Property Profile of 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine
Property Insights of 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine
The XLogP value of 3.0773 indicates that 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.62 Ų, 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine 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-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine?
The CAS number of 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine is 5979-86-2.
What is the molecular formula of 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine?
The molecular formula of 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine is C18H16ClFN2O2.
What is the molecular weight of 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine?
The molecular weight of 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine is 346.09 g/mol.
Where can I buy 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine?
You can request a quote for 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chlorobenzoyl)-4-(4-fluorobenzoyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.