![N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide structure](/static/products/816/816440-64-9.png)
N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide
TL;DR: N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide (CAS 816440-64-9) is a chemical compound with molecular formula C27H28N4O2S and molecular weight 472.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide
Also Known As: AN-329/43449710, N-acetyl-N'-{2-[(4-benzhydryl-1-piperazinyl)carbonyl]phenyl}thiourea, N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide, N-{[(2-{[4-(diphenylmethyl)-1-piperazinyl]carbonyl}phenyl)amino]carbonothioyl}acetamide, N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]thiocarbamoyl]acetamide
| Molecular Formula | C27H28N4O2S |
|---|---|
| Molecular Weight | 472.19 g/mol |
| LogP | 4.0669 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.1933 |
| Heavy Atoms | 34 |
| Complexity | 1106.0613 |
Chemical Identifiers
| CAS Number | 816440-64-9 |
|---|---|
| SMILES | CC(=O)NC(=S)NC1=CC=CC=C1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide (CAS 816440-64-9), with molecular formula C27H28N4O2S and molecular weight 472.19 g/mol. IUPAC: N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide.
Chemical Property Profile of N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide
Property Insights of N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide
The XLogP value of 4.0669 indicates that N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide. Following Lipinski's Rule of Five, N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide 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-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide?
The CAS number of N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide is 816440-64-9.
What is the molecular formula of N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide?
The molecular formula of N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide is C27H28N4O2S.
What is the molecular weight of N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide?
The molecular weight of N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide is 472.19 g/mol.
Where can I buy N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide?
You can request a quote for N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]carbamothioyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.