1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine
TL;DR: 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine (CAS 347310-26-3) is a chemical compound with molecular formula C21H23BrN4O3 and molecular weight 458.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)-[4-(4-nitro-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone
Also Known As: 1-(4-bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine, (4-bromophenyl)-[4-(4-nitro-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone, 4-bromophenyl 4-(4-nitro-3-pyrrolidinylphenyl)piperazinyl ketone, (4-bromophenyl)(4-(4-nitro-3-(pyrrolidin-1-yl)phenyl)piperazin-1-yl)methanone, (4-bromophenyl){4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}methanone
| Molecular Formula | C21H23BrN4O3 |
|---|---|
| Molecular Weight | 458.10 g/mol |
| LogP | 3.9199 |
| Topological Polar Surface Area | 69.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.09534 |
| Heavy Atoms | 29 |
| Complexity | 904.6423 |
Chemical Identifiers
| CAS Number | 347310-26-3 |
|---|---|
| SMILES | C1CCN(C1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Br)[N+](=O)[O-] |
Product Overview
1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine (CAS 347310-26-3), with molecular formula C21H23BrN4O3 and molecular weight 458.10 g/mol. IUPAC: (4-bromophenyl)-[4-(4-nitro-3-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone.
Chemical Property Profile of 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine
Property Insights of 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine
The XLogP value of 3.9199 indicates that 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine. Following Lipinski's Rule of Five, 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine has 0 hydrogen bond donor(s) and 5 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-nitro-3-pyrrolidin-1-ylphenyl}piperazine?
The CAS number of 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine is 347310-26-3.
What is the molecular formula of 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine?
The molecular formula of 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine is C21H23BrN4O3.
What is the molecular weight of 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine?
The molecular weight of 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine is 458.10 g/mol.
Where can I buy 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine?
You can request a quote for 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}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-nitro-3-pyrrolidin-1-ylphenyl}piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromobenzoyl)-4-{4-nitro-3-pyrrolidin-1-ylphenyl}piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.