![N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide structure](/static/products/3386/33860-29-6.webp)
N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide
TL;DR: N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide (CAS 33860-29-6) is a chemical compound with molecular formula C13H17N3OS and molecular weight 263.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylpiperazine-1-carbothioyl)benzamide
Also Known As: N-(4-methylpiperazine-1-carbothioyl)benzamide, BAS 00792048, N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide, N-(4-Methyl-piperazine-1-carbothioyl)-benzamide, N-[(4-methylpiperazinyl)thioxomethyl]benzamide
| Molecular Formula | C13H17N3OS |
|---|---|
| Molecular Weight | 263.11 g/mol |
| LogP | 0.9487 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.10922 |
| Heavy Atoms | 18 |
| Complexity | 427.1223 |
Chemical Identifiers
| CAS Number | 33860-29-6 |
|---|---|
| SMILES | CN1CCN(CC1)C(=S)NC(=O)C2=CC=CC=C2 |
Product Overview
N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide (CAS 33860-29-6), with molecular formula C13H17N3OS and molecular weight 263.11 g/mol. IUPAC: N-(4-methylpiperazine-1-carbothioyl)benzamide.
Chemical Property Profile of N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide
Property Insights of N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide
The XLogP value of 0.9487 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide. With a topological polar surface area (TPSA) of 35.58 Ų, N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide 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-Methyl-1-piperazinyl)thioxomethyl]benzamide?
The CAS number of N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide is 33860-29-6.
What is the molecular formula of N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide?
The molecular formula of N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide is C13H17N3OS.
What is the molecular weight of N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide?
The molecular weight of N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide is 263.11 g/mol.
Where can I buy N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide?
You can request a quote for N-[(4-Methyl-1-piperazinyl)thioxomethyl]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-Methyl-1-piperazinyl)thioxomethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-Methyl-1-piperazinyl)thioxomethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.