1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine
TL;DR: 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine (CAS 5670-47-3) is a chemical compound with molecular formula C17H15BrClN3O3 and molecular weight 423.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone
Also Known As: BIM-0000649.P001, 1-(4-bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine, (4-bromophenyl)-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone, (4-bromophenyl)[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone
| Molecular Formula | C17H15BrClN3O3 |
|---|---|
| Molecular Weight | 423.00 g/mol |
| LogP | 3.9731 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.99854 |
| Heavy Atoms | 25 |
| Complexity | 805.2854 |
Chemical Identifiers
| CAS Number | 5670-47-3 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)Br |
Product Overview
1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine (CAS 5670-47-3), with molecular formula C17H15BrClN3O3 and molecular weight 423.00 g/mol. IUPAC: (4-bromophenyl)-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine
Property Insights of 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine
The XLogP value of 3.9731 indicates that 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)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-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine. Following Lipinski's Rule of Five, 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)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-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine?
The CAS number of 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine is 5670-47-3.
What is the molecular formula of 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine?
The molecular formula of 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine is C17H15BrClN3O3.
What is the molecular weight of 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine?
The molecular weight of 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine is 423.00 g/mol.
Where can I buy 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine?
You can request a quote for 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromobenzoyl)-4-(4-chloro-2-nitrophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.