TL;DR: Methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate (CAS 1008955-24-5) is a chemical compound with molecular formula C14H16N2O4 and molecular weight 276.111 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(1-benzoyl-3-oxopiperazin-2-yl)acetate
Also Known As: BAS 07100578, IDI1_024519, methyl 2-(1-benzoyl-3-oxopiperazin-2-yl)acetate, methyl (1-benzoyl-3-oxo-2-piperazinyl)acetate, methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate
| Molecular Formula | C14H16N2O4 |
| Molecular Weight | 276.111 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 75.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.111 Da |
| Heavy Atoms | 20 |
| Complexity | 391.0 |
| SMILES | COC(=O)CC1C(=O)NCCN1C(=O)C2=CC=CC=C2 |
| InChIKey | QYZQCZGPCOJAAM-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate. Following Lipinski's Rule of Five, Methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate has 1 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 Methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate is 1008955-24-5.
The molecular formula of Methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate is C14H16N2O4.
The molecular weight of Methyl 2-[3-oxo-1-(phenylcarbonyl)piperazin-2-yl]acetate is 276.111 g/mol.
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