1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine
TL;DR: 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine (CAS 354535-46-9) is a chemical compound with molecular formula C18H18F2N2O and molecular weight 316.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-fluorophenyl)-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]methanone
Also Known As: BAS 01839808, 1-(3-fluorobenzoyl)-4-(2-fluorobenzyl)piperazine, AB00098393-01, (3-fluorophenyl)-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]methanone, [4-(2-fluorobenzyl)piperazin-1-yl](3-fluorophenyl)methanone
| Molecular Formula | C18H18F2N2O |
|---|---|
| Molecular Weight | 316.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.13873 |
| Heavy Atoms | 23 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 354535-46-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2F)C(=O)C3=CC(=CC=C3)F |
| InChIKey | UEEBDDNRKGHZNS-UHFFFAOYSA-N |
Product Overview
1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine (CAS 354535-46-9), with molecular formula C18H18F2N2O and molecular weight 316.14 g/mol. IUPAC: (3-fluorophenyl)-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]methanone.
Chemical Property Profile of 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine
Property Insights of 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine. With a topological polar surface area (TPSA) of 23.6 Ų, 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine has 0 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-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine?
The CAS number of 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine is 354535-46-9.
What is the molecular formula of 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine?
The molecular formula of 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine is C18H18F2N2O.
What is the molecular weight of 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine?
The molecular weight of 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine is 316.14 g/mol.
Where can I buy 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine?
You can request a quote for 1-(3-Fluorobenzoyl)-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-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Fluorobenzoyl)-4-(2-fluorobenzyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.