(4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone structure

(4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone

TL;DR: (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone (CAS 588674-22-0) is a chemical compound with molecular formula C17H18BrClN2OS and molecular weight 412.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

(4-bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone

Also Known As: (4-bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone, 4-bromo-5-ethyl(2-thienyl) 4-(3-chlorophenyl)piperazinyl ketone, (4-BROMO-5-ETHYL-2-THIENYL)[4-(3-CHLOROPHENYL)PIPERAZINO]METHANONE, (4-bromo-5-ethylthiophen-2-yl)[4-(3-chlorophenyl)piperazin-1-yl]methanone, (4-bromo-5-ethyl-thiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone

CAS: 588674-22-0
Molecular Formula C17H18BrClN2OS
Molecular Weight 412.00 g/mol
LogP 4.6888
Topological Polar Surface Area 23.55 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 412.00116
Heavy Atoms 23
Complexity 710.36896

Chemical Identifiers

CAS Number 588674-22-0
SMILES CCC1=C(C=C(S1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)Br

Product Overview

(4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone (CAS 588674-22-0), with molecular formula C17H18BrClN2OS and molecular weight 412.00 g/mol. IUPAC: (4-bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone

XLogP
4.6888
TPSA (Topological Polar Surface Area)
23.55
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
3
Heavy Atoms
23
Complexity
710.36896
Exact Mass
412.00116
Monoisotopic Mass
412.00116
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone

The XLogP value of 4.6888 indicates that (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone?

The CAS number of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone is 588674-22-0.

What is the molecular formula of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone?

The molecular formula of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone is C17H18BrClN2OS.

What is the molecular weight of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone?

The molecular weight of (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone is 412.00 g/mol.

Where can I buy (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone?

You can request a quote for (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)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-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone?

Yes, KEHONG BIO provides custom synthesis services for (4-Bromo-5-ethylthiophen-2-yl)-[4-(3-chlorophenyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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