N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide
TL;DR: N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide (CAS 709624-53-3) is a chemical compound with molecular formula C25H26N4OS and molecular weight 430.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-benzylpiperazin-1-yl)phenyl]carbamothioyl]benzamide
Also Known As: N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide, N-[[4-(4-benzylpiperazin-1-yl)phenyl]carbamothioyl]benzamide, N-[[4-(4-benzylpiperazin-1-yl)phenyl]thiocarbamoyl]benzamide, N-{[4-(4-benzylpiperazin-1-yl)phenyl]carbamothioyl}benzamide
| Molecular Formula | C25H26N4OS |
|---|---|
| Molecular Weight | 430.18 g/mol |
| LogP | 4.1356 |
| Topological Polar Surface Area | 47.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.18274 |
| Heavy Atoms | 31 |
| Complexity | 1000.71155 |
Chemical Identifiers
| CAS Number | 709624-53-3 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=CC=C4 |
Product Overview
N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide (CAS 709624-53-3), with molecular formula C25H26N4OS and molecular weight 430.18 g/mol. IUPAC: N-[[4-(4-benzylpiperazin-1-yl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide
Property Insights of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide
The XLogP value of 4.1356 indicates that N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.61 Ų, N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide has 2 hydrogen bond donor(s) and 4 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-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide?
The CAS number of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide is 709624-53-3.
What is the molecular formula of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide?
The molecular formula of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide is C25H26N4OS.
What is the molecular weight of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide?
The molecular weight of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide is 430.18 g/mol.
Where can I buy N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide?
You can request a quote for N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.