1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine
TL;DR: 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine (CAS 330601-48-4) is a chemical compound with molecular formula C12H14ClFN2O and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
Also Known As: 1-(CHLOROACETYL)-4-(4-FLUOROPHENYL)PIPERAZINE, 2-chloro-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone, BAS 13318552, Piperazine, 1-(chloroacetyl)-4-(4-fluorophenyl)-, 2-Chloro-1-[4-(4-fluoro-phenyl)-piperazin-1-yl]-ethanone
| Molecular Formula | C12H14ClFN2O |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 1.7131 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.07788 |
| Heavy Atoms | 17 |
| Complexity | 387.99704 |
Chemical Identifiers
| CAS Number | 330601-48-4 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCl |
Product Overview
1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine (CAS 330601-48-4), with molecular formula C12H14ClFN2O and molecular weight 256.08 g/mol. IUPAC: 2-chloro-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone.
Chemical Property Profile of 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine
Property Insights of 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine
The XLogP value of 1.7131 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine. With a topological polar surface area (TPSA) of 23.55 Ų, 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Chloroacetyl)-4-(4-fluorophenyl)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-(Chloroacetyl)-4-(4-fluorophenyl)piperazine?
The CAS number of 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine is 330601-48-4.
What is the molecular formula of 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine?
The molecular formula of 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine is C12H14ClFN2O.
What is the molecular weight of 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine?
The molecular weight of 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine is 256.08 g/mol.
Where can I buy 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine?
You can request a quote for 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Chloroacetyl)-4-(4-fluorophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.