TL;DR: 3-(Furan-2-ylmethylidene)piperazine-2,5-dione (CAS 155527-33-6) is a chemical compound with molecular formula C9H8N2O3 and molecular weight 192.0535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(furan-2-ylmethylidene)piperazine-2,5-dione
Also Known As: 3-(furan-2-ylmethylidene)piperazine-2,5-dione, 3-(2-furylmethylene)tetrahydro-2,5-pyrazinedione, 3-(2-furylmethylidene)piperazine-2,5-dione
| Molecular Formula | C9H8N2O3 |
| Molecular Weight | 192.0535 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 71.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.0535 Da |
| Heavy Atoms | 14 |
| Complexity | 298.0 |
| SMILES | C1C(=O)NC(=CC2=CC=CO2)C(=O)N1 |
| InChIKey | PTQUYLDFHURNBC-UHFFFAOYSA-N |
The XLogP value of -0.1 indicates that 3-(Furan-2-ylmethylidene)piperazine-2,5-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Furan-2-ylmethylidene)piperazine-2,5-dione. Following Lipinski's Rule of Five, 3-(Furan-2-ylmethylidene)piperazine-2,5-dione has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(Furan-2-ylmethylidene)piperazine-2,5-dione is 155527-33-6.
The molecular formula of 3-(Furan-2-ylmethylidene)piperazine-2,5-dione is C9H8N2O3.
The molecular weight of 3-(Furan-2-ylmethylidene)piperazine-2,5-dione is 192.0535 g/mol.
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