TL;DR: 2-[1-[3-(2-Methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid (CAS 1037015-75-0) is a chemical compound with molecular formula C16H20N2O4 and molecular weight 304.1423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-[3-(2-methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid
Also Known As: BAS 12524914, {1-[3-(2-methoxyphenyl)-2-propen-1-yl]-3-oxo-2-piperazinyl}acetic acid, 2-[1-[3-(2-methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid, {1-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-yl]-3-oxopiperazin-2-yl}acetic acid, 2-{1-[(E)-3-(2-Methoxyphenyl)-2-propenyl]-3-oxo-2-piperazinyl}acetic acid
| Molecular Formula | C16H20N2O4 |
| Molecular Weight | 304.1423 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 304.1423 Da |
| Heavy Atoms | 22 |
| Complexity | 424.0 |
| SMILES | COC1=CC=CC=C1C=CCN2CCNC(=O)C2CC(=O)O |
| InChIKey | ZBXZZODSQINRIV-UHFFFAOYSA-N |
The XLogP value of -1.3 indicates that 2-[1-[3-(2-Methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-[3-(2-Methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid. Following Lipinski's Rule of Five, 2-[1-[3-(2-Methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[1-[3-(2-Methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid is 1037015-75-0.
The molecular formula of 2-[1-[3-(2-Methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid is C16H20N2O4.
The molecular weight of 2-[1-[3-(2-Methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]acetic acid is 304.1423 g/mol.
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