TL;DR: [1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid (CAS 1033600-34-8) is a chemical compound with molecular formula C15H20N2O5 and molecular weight 308.1372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-[(2,4-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetic acid
Also Known As: [1-(2,4-dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid|KS-00003ZH0|BAS 11820067|2-(1-(2,4-dimethoxybenzyl)-3-oxopiperazin-2-yl)acetic acid|2-[1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid|2-[1-[(2,4-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetic acid|AN-329/43041699|SR-01000014502-1|F1723-0012|[1-(2,4-dimethoxybenzyl)-3-oxopiperazin-2-yl]acetic acid|[1-(2,4-Dimethoxy-benzyl)-3-oxo-piperazin-2-yl]-acetic acid|MLS000100440|CHEMBL1472448|STK329127|SMR000018836|SR-01000014502
| Molecular Formula | C15H20N2O5 |
| Molecular Weight | 308.1372 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 88.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.1372 Da |
| Heavy Atoms | 22 |
| Complexity | 403.0 |
| SMILES | COC1=CC(=C(C=C1)CN2CCNC(=O)C2CC(=O)O)OC |
| InChIKey | NDHQXIIVAUUZKN-UHFFFAOYSA-N |
The XLogP value of -1.9 indicates that [1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid. Following Lipinski's Rule of Five, [1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid is 1033600-34-8.
The molecular formula of [1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid is C15H20N2O5.
The molecular weight of [1-(2,4-Dimethoxybenzyl)-3-oxo-2-piperazinyl]acetic acid is 308.1372 g/mol.
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