![(4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone structure](/static/products/5886/588686-58-2.webp)
(4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone
TL;DR: (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone (CAS 588686-58-2) is a chemical compound with molecular formula C15H14BrN3O3S and molecular weight 394.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone
Also Known As: (4-bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone, 4-bromo(2-thienyl) 4-(4-nitrophenyl)piperazinyl ketone, (4-BROMO-2-THIENYL)[4-(4-NITROPHENYL)PIPERAZINO]METHANONE, (4-bromothiophen-2-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
| Molecular Formula | C15H14BrN3O3S |
|---|---|
| Molecular Weight | 394.99 g/mol |
| LogP | 3.3812 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.99393 |
| Heavy Atoms | 23 |
| Complexity | 723.82324 |
Chemical Identifiers
| CAS Number | 588686-58-2 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=CS3)Br |
Product Overview
(4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone (CAS 588686-58-2), with molecular formula C15H14BrN3O3S and molecular weight 394.99 g/mol. IUPAC: (4-bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone
Property Insights of (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone
The XLogP value of 3.3812 indicates that (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone 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 (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone. Following Lipinski's Rule of Five, (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone 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 (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone?
The CAS number of (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone is 588686-58-2.
What is the molecular formula of (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone?
The molecular formula of (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone is C15H14BrN3O3S.
What is the molecular weight of (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone?
The molecular weight of (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone is 394.99 g/mol.
Where can I buy (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone?
You can request a quote for (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromothiophen-2-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.