TL;DR: (1-Neopentyl-3-oxo-2-piperazinyl)acetic acid (CAS 1033600-14-4) is a chemical compound with molecular formula C11H20N2O3 and molecular weight 228.1474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-(2,2-dimethylpropyl)-3-oxopiperazin-2-yl]acetic acid
Also Known As: starbld0047725, (1-neopentyl-3-oxo-2-piperazinyl)acetic acid, 2-(1-Neopentyl-3-oxopiperazin-2-yl)acetic acid, 2-(1-neopentyl-3-oxo-2-piperazinyl)acetic acid, 2-[1-(2,2-dimethylpropyl)-3-oxopiperazin-2-yl]acetic acid
| Molecular Formula | C11H20N2O3 |
| Molecular Weight | 228.1474 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.1474 Da |
| Heavy Atoms | 16 |
| Complexity | 283.0 |
| SMILES | CC(C)(C)CN1CCNC(=O)C1CC(=O)O |
| InChIKey | OHVZFAKJLVVGKW-UHFFFAOYSA-N |
The XLogP value of -1.6 indicates that (1-Neopentyl-3-oxo-2-piperazinyl)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Neopentyl-3-oxo-2-piperazinyl)acetic acid. Following Lipinski's Rule of Five, (1-Neopentyl-3-oxo-2-piperazinyl)acetic acid has 2 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-Neopentyl-3-oxo-2-piperazinyl)acetic acid is 1033600-14-4.
The molecular formula of (1-Neopentyl-3-oxo-2-piperazinyl)acetic acid is C11H20N2O3.
The molecular weight of (1-Neopentyl-3-oxo-2-piperazinyl)acetic acid is 228.1474 g/mol.
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