![3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone structure](/static/products/5886/588675-48-3.webp)
3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone
TL;DR: 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone (CAS 588675-48-3) is a chemical compound with molecular formula C15H16ClFN2OS and molecular weight 326.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-4-fluoro-1-benzothiophen-2-yl)-(4-ethylpiperazin-1-yl)methanone
Also Known As: 3-chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone, (3-Chloro-4-Fluoro-1-Benzothiophen-2-Yl)(4-Ethyl-1-Piperazinyl)Methanone, (3-chloro-4-fluoro-1-benzothiophen-2-yl)(4-ethylpiperazin-1-yl)methanone, (3-chloro-4-fluoro-1-benzothiophen-2-yl)-(4-ethylpiperazin-1-yl)methanone, (3-chloro-4-fluoro-benzothiophen-2-yl)-(4-ethylpiperazin-1-yl)methanone
| Molecular Formula | C15H16ClFN2OS |
|---|---|
| Molecular Weight | 326.07 g/mol |
| LogP | 3.4715 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.06558 |
| Heavy Atoms | 21 |
| Complexity | 679.6086 |
Chemical Identifiers
| CAS Number | 588675-48-3 |
|---|---|
| SMILES | CCN1CCN(CC1)C(=O)C2=C(C3=C(C=CC=C3S2)F)Cl |
Product Overview
3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone (CAS 588675-48-3), with molecular formula C15H16ClFN2OS and molecular weight 326.07 g/mol. IUPAC: (3-chloro-4-fluoro-1-benzothiophen-2-yl)-(4-ethylpiperazin-1-yl)methanone.
Chemical Property Profile of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone
Property Insights of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone
The XLogP value of 3.4715 indicates that 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone 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
Frequently Asked Questions
What is the CAS number of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone?
The CAS number of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone is 588675-48-3.
What is the molecular formula of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone?
The molecular formula of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone is C15H16ClFN2OS.
What is the molecular weight of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone?
The molecular weight of 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone is 326.07 g/mol.
Where can I buy 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone?
You can request a quote for 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-4-fluorobenzo[b]thiophen-2-yl 4-ethylpiperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.