![1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one structure](/static/products/1784/178408-16-7.webp)
1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one
TL;DR: 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one (CAS 178408-16-7) is a chemical compound with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one
Also Known As: 1-methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one, 1-methyl-3-[2-oxo-2-(p-tolyl)ethylidene]piperazin-2-one, 2-Piperazinone, 1-methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]-, 1-Methyl-3-(2-(4-methylphenyl)-2-oxoethylidene)piperazinone, 2-Piperazinone,1-methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]-
| Molecular Formula | C14H16N2O2 |
|---|---|
| Molecular Weight | 244.12 g/mol |
| LogP | 1.12322 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.12119 |
| Heavy Atoms | 18 |
| Complexity | 503.0302 |
Chemical Identifiers
| CAS Number | 178408-16-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C=C2C(=O)N(CCN2)C |
Product Overview
1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one (CAS 178408-16-7), with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol. IUPAC: 1-methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one.
Chemical Property Profile of 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one
Property Insights of 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one
The XLogP value of 1.12322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one. With a topological polar surface area (TPSA) of 49.41 Ų, 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one 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 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one?
The CAS number of 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one is 178408-16-7.
What is the molecular formula of 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one?
The molecular formula of 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one is C14H16N2O2.
What is the molecular weight of 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one?
The molecular weight of 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one is 244.12 g/mol.
Where can I buy 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one?
You can request a quote for 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-[2-(4-methylphenyl)-2-oxoethylidene]piperazin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.