2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide
TL;DR: 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide (CAS 791790-91-5) is a chemical compound with molecular formula C14H19N3OS and molecular weight 277.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide
Also Known As: AN-329/42504599, 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide, 2-methyl-N-[(4-methyl-1-piperazinyl)carbothioyl]benzamide, 2-methyl-N-[(4-methyl-1-piperazinyl)carbonothioyl]benzamide, 2-methyl-N-[(4-methylpiperazin-1-yl)carbonothioyl]benzamide
| Molecular Formula | C14H19N3OS |
|---|---|
| Molecular Weight | 277.12 g/mol |
| LogP | 1.25712 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.12488 |
| Heavy Atoms | 19 |
| Complexity | 481.33435 |
Chemical Identifiers
| CAS Number | 791790-91-5 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC(=S)N2CCN(CC2)C |
Product Overview
2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide (CAS 791790-91-5), with molecular formula C14H19N3OS and molecular weight 277.12 g/mol. IUPAC: 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide.
Chemical Property Profile of 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide
Property Insights of 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide
The XLogP value of 1.25712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide. With a topological polar surface area (TPSA) of 35.58 Ų, 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methyl-N-(4-methylpiperazine-1-carbothioyl)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 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide?
The CAS number of 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide is 791790-91-5.
What is the molecular formula of 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide?
The molecular formula of 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide is C14H19N3OS.
What is the molecular weight of 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide?
The molecular weight of 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide is 277.12 g/mol.
Where can I buy 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide?
You can request a quote for 2-methyl-N-(4-methylpiperazine-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 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-N-(4-methylpiperazine-1-carbothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.