1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine
TL;DR: 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine (CAS 441743-22-2) is a chemical compound with molecular formula C18H18ClFN2O and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chlorophenyl)-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]methanone
Also Known As: 1-(3-chlorobenzoyl)-4-(2-fluorobenzyl)piperazine, (3-chlorophenyl)-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]methanone, (3-chlorophenyl)-[4-(2-fluorobenzyl)piperazino]methanone, (3-chlorophenyl)[4-(2-fluorobenzyl)piperazin-1-yl]methanone, (3-CHLOROPHENYL)[4-(2-FLUOROBENZYL)PIPERAZINO]METHANONE
| Molecular Formula | C18H18ClFN2O |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.10916 |
| Heavy Atoms | 23 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 441743-22-2 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2F)C(=O)C3=CC(=CC=C3)Cl |
| InChIKey | UKGTYZAQCVLMAU-UHFFFAOYSA-N |
Product Overview
1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine (CAS 441743-22-2), with molecular formula C18H18ClFN2O and molecular weight 332.11 g/mol. IUPAC: (3-chlorophenyl)-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]methanone.
Chemical Property Profile of 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine
Property Insights of 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine
The XLogP value of 3.4 indicates that 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine has 0 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 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine?
The CAS number of 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine is 441743-22-2.
What is the molecular formula of 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine?
The molecular formula of 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine is C18H18ClFN2O.
What is the molecular weight of 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine?
The molecular weight of 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine is 332.11 g/mol.
Where can I buy 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine?
You can request a quote for 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)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-(2-fluorobenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chlorobenzoyl)-4-(2-fluorobenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.