N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide
TL;DR: N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide (CAS 674816-93-4) is a chemical compound with molecular formula C26H28N4O2S and molecular weight 460.19 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]-4-methoxybenzamide
Also Known As: 1-[4-(4-BENZYLPIPERAZIN-1-YL)PHENYL]-3-(4-METHOXYBENZOYL)THIOUREA, N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide, N-[[4-(4-benzylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxybenzamide, N-[[4-(4-benzylpiperazin-1-yl)phenyl]thiocarbamoyl]-4-methoxy-benzamide, N-{[4-(4-benzylpiperazin-1-yl)phenyl]carbamothioyl}-4-methoxybenzamide
| Molecular Formula | C26H28N4O2S |
|---|---|
| Molecular Weight | 460.19 g/mol |
| LogP | 4.1442 |
| Topological Polar Surface Area | 56.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.1933 |
| Heavy Atoms | 33 |
| Complexity | 1063.7107 |
Chemical Identifiers
| CAS Number | 674816-93-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4 |
Product Overview
N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide (CAS 674816-93-4), with molecular formula C26H28N4O2S and molecular weight 460.19 g/mol. IUPAC: N-[[4-(4-benzylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxybenzamide.
Chemical Property Profile of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide
Property Insights of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide
The XLogP value of 4.1442 indicates that N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.84 Ų, N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide has 2 hydrogen bond donor(s) and 5 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)-4-methoxybenzamide?
The CAS number of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide is 674816-93-4.
What is the molecular formula of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
The molecular formula of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide is C26H28N4O2S.
What is the molecular weight of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
The molecular weight of N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide is 460.19 g/mol.
Where can I buy N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
You can request a quote for N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide 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)-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((4-(4-benzylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.