TL;DR: 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione (CAS 1337926-16-5) is a chemical compound with molecular formula C16H18ClN3O3 and molecular weight 335.10367 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxoethyl]pyrrolidine-2,5-dione
Also Known As: 2,5-Pyrrolidinedione, 1-[2-[4-(2-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-, 1-[2-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxoethyl]pyrrolidine-2,5-dione, 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione
| Molecular Formula | C16H18ClN3O3 |
| Molecular Weight | 335.10367 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.10367 Da |
| Heavy Atoms | 23 |
| Complexity | 475.0 |
| SMILES | C1CC(=O)N(C1=O)CC(=O)N2CCN(CC2)C3=CC=CC=C3Cl |
| InChIKey | MRAWHWIVRXDZQZ-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione. Following Lipinski's Rule of Five, 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione is 1337926-16-5.
The molecular formula of 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione is C16H18ClN3O3.
The molecular weight of 1-{2-[4-(2-Chlorophenyl)piperazin-1-yl]-2-oxoethyl}pyrrolidine-2,5-dione is 335.10367 g/mol.
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