![4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide structure](/static/products/590/590358-50-2.png)
4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
TL;DR: 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide (CAS 590358-50-2) is a chemical compound with molecular formula C24H26N6O2S2 and molecular weight 494.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
Also Known As: 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide, 4-cinnamyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide, {[4-({[4-((2E)-3-phenylprop-2-enyl)piperazinyl]thioxomethyl}amino)phenyl]sulfo nyl}pyrimidin-2-ylamine, 4-[(2E)-3-phenylprop-2-en-1-yl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
| Molecular Formula | C24H26N6O2S2 |
|---|---|
| Molecular Weight | 494.16 g/mol |
| LogP | 3.3052 |
| Topological Polar Surface Area | 90.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.15585 |
| Heavy Atoms | 34 |
| Complexity | 1211.3376 |
Chemical Identifiers
| CAS Number | 590358-50-2 |
|---|---|
| SMILES | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4 |
Product Overview
4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide (CAS 590358-50-2), with molecular formula C24H26N6O2S2 and molecular weight 494.16 g/mol. IUPAC: 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide.
Chemical Property Profile of 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
Property Insights of 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide
The XLogP value of 3.3052 indicates that 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide. Following Lipinski's Rule of Five, 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide has 2 hydrogen bond donor(s) and 6 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-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide?
The CAS number of 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide is 590358-50-2.
What is the molecular formula of 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide?
The molecular formula of 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide is C24H26N6O2S2.
What is the molecular weight of 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide?
The molecular weight of 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide is 494.16 g/mol.
Where can I buy 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide?
You can request a quote for 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[(E)-3-phenylprop-2-enyl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.