TL;DR: 2-[1-(4-Ethoxybenzyl)-3-oxo-2-piperazinyl]-acetic acid (CAS 1042696-40-1) is a chemical compound with molecular formula C15H20N2O4 and molecular weight 292.1423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetic acid
Also Known As: 2-[1-(4-ETHOXYBENZYL)-3-OXO-2-PIPERAZINYL]-ACETIC ACID, [1-(4-ethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid, 2-[1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetic acid, 2-{1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-2-yl}acetic acid, Z-0916
| Molecular Formula | C15H20N2O4 |
| Molecular Weight | 292.1423 g/mol |
| XLogP | -1.5 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.1423 Da |
| Heavy Atoms | 21 |
| Complexity | 367.0 |
| SMILES | CCOC1=CC=C(C=C1)CN2CCNC(=O)C2CC(=O)O |
| InChIKey | UFAPTAYBYWFFKM-UHFFFAOYSA-N |
The XLogP value of -1.5 indicates that 2-[1-(4-Ethoxybenzyl)-3-oxo-2-piperazinyl]-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-(4-Ethoxybenzyl)-3-oxo-2-piperazinyl]-acetic acid. Following Lipinski's Rule of Five, 2-[1-(4-Ethoxybenzyl)-3-oxo-2-piperazinyl]-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-(4-Ethoxybenzyl)-3-oxo-2-piperazinyl]-acetic acid is 1042696-40-1.
The molecular formula of 2-[1-(4-Ethoxybenzyl)-3-oxo-2-piperazinyl]-acetic acid is C15H20N2O4.
The molecular weight of 2-[1-(4-Ethoxybenzyl)-3-oxo-2-piperazinyl]-acetic acid is 292.1423 g/mol.
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