(3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone
TL;DR: (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone (CAS 898136-55-5) is a chemical compound with molecular formula C16H17ClN2OS and molecular weight 320.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone
Also Known As: (3-chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone, 3-chlorobenzo[b]thiophen-2-yl 4-prop-2-enylpiperazinyl ketone, (3-chlorobenzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone, (3-chloro-1-benzothiophen-2-yl)[4-(prop-2-en-1-yl)piperazin-1-yl]methanone
| Molecular Formula | C16H17ClN2OS |
|---|---|
| Molecular Weight | 320.07 g/mol |
| LogP | 3.4985 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.075 |
| Heavy Atoms | 21 |
| Complexity | 673.96686 |
Chemical Identifiers
| CAS Number | 898136-55-5 |
|---|---|
| SMILES | C=CCN1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3S2)Cl |
Product Overview
(3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone (CAS 898136-55-5), with molecular formula C16H17ClN2OS and molecular weight 320.07 g/mol. IUPAC: (3-chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone.
Chemical Property Profile of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone
Property Insights of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone
The XLogP value of 3.4985 indicates that (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-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, (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-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
Frequently Asked Questions
What is the CAS number of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone?
The CAS number of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone is 898136-55-5.
What is the molecular formula of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone?
The molecular formula of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone is C16H17ClN2OS.
What is the molecular weight of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone?
The molecular weight of (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone is 320.07 g/mol.
Where can I buy (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone?
You can request a quote for (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-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 (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Chloro-1-benzothiophen-2-yl)-(4-prop-2-enylpiperazin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.