4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone
TL;DR: 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone (CAS 1164519-16-7) is a chemical compound with molecular formula C18H20N2OS and molecular weight 312.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-thiophen-2-ylmethanone
Also Known As: BAS 03585772, 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone, (E)-(4-cinnamylpiperazin-1-yl)(thiophen-2-yl)methanone, [4-(3-Phenyl-allyl)-piperazin-1-yl]-thiophen-2-yl-methanone, {4-[(E)-3-phenyl-2-propenyl]piperazino}(2-thienyl)methanone
| Molecular Formula | C18H20N2OS |
|---|---|
| Molecular Weight | 312.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.12964 |
| Heavy Atoms | 22 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 1164519-16-7 |
|---|---|
| SMILES | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=O)C3=CC=CS3 |
| InChIKey | AMEOHHNHJQAZNI-XBXARRHUSA-N |
Product Overview
4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone (CAS 1164519-16-7), with molecular formula C18H20N2OS and molecular weight 312.13 g/mol. IUPAC: [4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone
Property Insights of 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone
The XLogP value of 3.3 indicates that 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl 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 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone?
The CAS number of 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone is 1164519-16-7.
What is the molecular formula of 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone?
The molecular formula of 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone is C18H20N2OS.
What is the molecular weight of 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone?
The molecular weight of 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone is 312.13 g/mol.
Where can I buy 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone?
You can request a quote for 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 4-((2E)-3-phenylprop-2-enyl)piperazinyl 2-thienyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.