![N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide structure](/static/products/4960/496054-72-9.webp)
N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide
TL;DR: N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide (CAS 496054-72-9) is a chemical compound with molecular formula C17H18N4OS and molecular weight 326.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-pyridin-2-ylpiperazine-1-carbothioyl)benzamide
Also Known As: N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide, N-(4-pyridin-2-ylpiperazine-1-carbothioyl)benzamide, AO-990/15068119, N-[4-(2-pyridyl)piperazine-1-carbothioyl]benzamide, N-{[4-(2-pyridinyl)-1-piperazinyl]carbothioyl}benzamide
| Molecular Formula | C17H18N4OS |
|---|---|
| Molecular Weight | 326.12 g/mol |
| LogP | 1.9185 |
| Topological Polar Surface Area | 48.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.12012 |
| Heavy Atoms | 23 |
| Complexity | 669.50745 |
Chemical Identifiers
| CAS Number | 496054-72-9 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=N2)C(=S)NC(=O)C3=CC=CC=C3 |
Product Overview
N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide (CAS 496054-72-9), with molecular formula C17H18N4OS and molecular weight 326.12 g/mol. IUPAC: N-(4-pyridin-2-ylpiperazine-1-carbothioyl)benzamide.
Chemical Property Profile of N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide
Property Insights of N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide
The XLogP value of 1.9185 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide. With a topological polar surface area (TPSA) of 48.47 Ų, N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide has 1 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-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide?
The CAS number of N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide is 496054-72-9.
What is the molecular formula of N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide?
The molecular formula of N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide is C17H18N4OS.
What is the molecular weight of N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide?
The molecular weight of N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide is 326.12 g/mol.
Where can I buy N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide?
You can request a quote for N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]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-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(pyridin-2-yl)piperazine-1-carbothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.