N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide
TL;DR: N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide (CAS 1164545-63-4) is a chemical compound with molecular formula C21H25N3OS and molecular weight 367.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide
Also Known As: N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide, N-(4-methoxyphenyl)-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbothioamide, N-(4-methoxyphenyl)-4-(3-phenyl-2-propen-1-yl)-1-piperazinecarbothioamide
| Molecular Formula | C21H25N3OS |
|---|---|
| Molecular Weight | 367.17 g/mol |
| LogP | 3.723 |
| Topological Polar Surface Area | 27.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.17184 |
| Heavy Atoms | 26 |
| Complexity | 722.6812 |
Chemical Identifiers
| CAS Number | 1164545-63-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C/C=C/C3=CC=CC=C3 |
Product Overview
N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide (CAS 1164545-63-4), with molecular formula C21H25N3OS and molecular weight 367.17 g/mol. IUPAC: N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide.
Chemical Property Profile of N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide
Property Insights of N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide
The XLogP value of 3.723 indicates that N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.74 Ų, N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide has 1 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 N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide?
The CAS number of N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide is 1164545-63-4.
What is the molecular formula of N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide?
The molecular formula of N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide is C21H25N3OS.
What is the molecular weight of N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide?
The molecular weight of N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide is 367.17 g/mol.
Where can I buy N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide?
You can request a quote for N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]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 N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methoxyphenyl)-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.