1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine
TL;DR: 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine (CAS 340014-67-7) is a chemical compound with molecular formula C17H15ClFN3O3 and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-chloro-2-nitrophenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone
Also Known As: 1-{5-chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine, 1-(5-chloro-2-nitrobenzoyl)-4-(4-fluorophenyl)piperazine, (5-chloro-2-nitrophenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone, A2045/0086001, (5-chloro-2-nitrophenyl)[4-(4-fluorophenyl)piperazin-1-yl]methanone
| Molecular Formula | C17H15ClFN3O3 |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | 3.3497 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.07858 |
| Heavy Atoms | 25 |
| Complexity | 805.2854 |
Chemical Identifiers
| CAS Number | 340014-67-7 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-] |
Product Overview
1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine (CAS 340014-67-7), with molecular formula C17H15ClFN3O3 and molecular weight 363.08 g/mol. IUPAC: (5-chloro-2-nitrophenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine
Property Insights of 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine
The XLogP value of 3.3497 indicates that 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine. Following Lipinski's Rule of Five, 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)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-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine?
The CAS number of 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine is 340014-67-7.
What is the molecular formula of 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine?
The molecular formula of 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine is C17H15ClFN3O3.
What is the molecular weight of 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine?
The molecular weight of 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine is 363.08 g/mol.
Where can I buy 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine?
You can request a quote for 1-{5-Chloro-2-nitrobenzoyl}-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-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-{5-Chloro-2-nitrobenzoyl}-4-(4-fluorophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.