3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine
TL;DR: 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine (CAS 130603-59-7) is a chemical compound with molecular formula C19H16N2O2 and molecular weight 304.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,6-dibenzylidene-1-methylpiperazine-2,5-dione
Also Known As: Piperafizine A, 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine, 3,6-Dibenzylidene-1-methylpiperazine-2,5-dione, (3Z,6Z)-3,6-dibenzylidene-1-methylpiperazine-2,5-dione
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C19H16N2O2 |
| Molecular Weight | 304.1212 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 304.1212 Da |
| Heavy Atoms | 23 |
| Complexity | 523.0 |
| SMILES | CN1C(=CC2=CC=CC=C2)C(=O)NC(=CC3=CC=CC=C3)C1=O |
| InChIKey | DILBTCUXPAXMSM-UHFFFAOYSA-N |
Chemical Property Profile of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine
Property Insights of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine
The XLogP value of 3.1 indicates that 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine?
The CAS number of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine is 130603-59-7.
What is the molecular formula of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine?
The molecular formula of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine is C19H16N2O2.
What is the molecular weight of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine?
The molecular weight of 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine is 304.1212 g/mol.
Where can I buy 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine?
You can request a quote for 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine?
Yes, CoreyChem provides custom synthesis services for 3,6-Dibenzylidene-1-methyl-2,5-dioxopiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.