TL;DR: 2-[3-Oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid (CAS 1164119-79-2) is a chemical compound with molecular formula C15H18N2O3 and molecular weight 274.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid
Also Known As: 2-[3-oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid, 2-{3-Oxo-1-[(E)-3-phenyl-2-propenyl]-2-piperazinyl}acetic acid
| Molecular Formula | C15H18N2O3 |
| Molecular Weight | 274.13174 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 73.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.13174 Da |
| Heavy Atoms | 20 |
| Complexity | 370.0 |
| SMILES | C1CN(C(C(=O)N1)CC(=O)O)CC=CC2=CC=CC=C2 |
| InChIKey | IDPYDWSNMOJIBU-UHFFFAOYSA-N |
The XLogP value of -0.6 indicates that 2-[3-Oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-Oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid. Following Lipinski's Rule of Five, 2-[3-Oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid 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 2-[3-Oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid is 1164119-79-2.
The molecular formula of 2-[3-Oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid is C15H18N2O3.
The molecular weight of 2-[3-Oxo-1-(3-phenylprop-2-enyl)piperazin-2-yl]acetic acid is 274.13174 g/mol.
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