1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine
TL;DR: 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine (CAS 462605-24-9) is a chemical compound with molecular formula C21H27FN2O and molecular weight 342.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-adamantyl)piperazin-1-yl]-(3-fluorophenyl)methanone
Also Known As: 1-(2-adamantyl)-4-(3-fluorobenzoyl)piperazine, BAS 04057292, 4-adamantan-2-ylpiperazinyl 3-fluorophenyl ketone, AT-057/43316691, [4-(2-adamantyl)piperazin-1-yl]-(3-fluorophenyl)methanone
| Molecular Formula | C21H27FN2O |
|---|---|
| Molecular Weight | 342.21 g/mol |
| LogP | 3.4082 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.21075 |
| Heavy Atoms | 25 |
| Complexity | 639.6148 |
Chemical Identifiers
| CAS Number | 462605-24-9 |
|---|---|
| SMILES | C1CN(CCN1C2C3CC4CC(C3)CC2C4)C(=O)C5=CC(=CC=C5)F |
Product Overview
1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine (CAS 462605-24-9), with molecular formula C21H27FN2O and molecular weight 342.21 g/mol. IUPAC: [4-(2-adamantyl)piperazin-1-yl]-(3-fluorophenyl)methanone.
Chemical Property Profile of 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine
Property Insights of 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine
The XLogP value of 3.4082 indicates that 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Adamantyl)-4-(3-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-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine?
The CAS number of 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine is 462605-24-9.
What is the molecular formula of 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine?
The molecular formula of 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine is C21H27FN2O.
What is the molecular weight of 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine?
The molecular weight of 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine is 342.21 g/mol.
Where can I buy 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine?
You can request a quote for 1-(2-Adamantyl)-4-(3-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-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Adamantyl)-4-(3-fluorobenzoyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.