![1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione structure](/static/products/1175/117563-26-5.webp)
1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione
TL;DR: 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione (CAS 117563-26-5) is a chemical compound with molecular formula C15H17N3O3 and molecular weight 287.12698 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione
Also Known As: 1-acetyl-3-[(4-dimethylaminophenyl)methylidene]piperazine-2,5-dione, 1-acetyl-3-{[4-(dimethylamino)phenyl]methylene}tetrahydro-2,5-pyrazinedione
Technical Specifications
| Molecular Formula | C15H17N3O3 |
| Molecular Weight | 287.12698 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 69.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.12698 Da |
| Heavy Atoms | 21 |
| Complexity | 477.0 |
| SMILES | CC(=O)N1CC(=O)NC(=CC2=CC=C(C=C2)N(C)C)C1=O |
| InChIKey | SYFVNJGPALDWRA-UHFFFAOYSA-N |
Chemical Property Profile of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione
Property Insights of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione. Following Lipinski's Rule of Five, 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione 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
What is the CAS number of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione?
The CAS number of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione is 117563-26-5.
What is the molecular formula of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione?
The molecular formula of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione is C15H17N3O3.
What is the molecular weight of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione?
The molecular weight of 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione is 287.12698 g/mol.
Where can I buy 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione?
You can request a quote for 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione?
Yes, CoreyChem provides custom synthesis services for 1-Acetyl-3-[[4-(dimethylamino)phenyl]methylidene]piperazine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.