Methyl 4-Boc-piperazine-2-acetate
TL;DR: Methyl 4-Boc-piperazine-2-acetate (CAS 1217810-25-7) is a chemical compound with molecular formula C12H22N2O4 and molecular weight 258.15796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl 3-(2-methoxy-2-oxoethyl)piperazine-1-carboxylate
Also Known As: tert-butyl 3-(2-methoxy-2-oxoethyl)piperazine-1-carboxylate, Methyl 4-Boc-piperazine-2-acetate, N-4-Boc-2-piperazineacetic acid methyl ester, Benzylisocyanate, 3-(2-Methoxy-2-oxoethyl)piperazine
Technical Specifications
| Molecular Formula | C12H22N2O4 |
| Molecular Weight | 258.15796 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.15796 Da |
| Heavy Atoms | 18 |
| Complexity | 312.0 |
| SMILES | CC(C)(C)OC(=O)N1CCNC(C1)CC(=O)OC |
| InChIKey | VLMVFRLASKOYKX-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-Boc-piperazine-2-acetate
Property Insights of Methyl 4-Boc-piperazine-2-acetate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-Boc-piperazine-2-acetate. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-Boc-piperazine-2-acetate. Following Lipinski's Rule of Five, Methyl 4-Boc-piperazine-2-acetate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 4-Boc-piperazine-2-acetate?
The CAS number of Methyl 4-Boc-piperazine-2-acetate is 1217810-25-7.
What is the molecular formula of Methyl 4-Boc-piperazine-2-acetate?
The molecular formula of Methyl 4-Boc-piperazine-2-acetate is C12H22N2O4.
What is the molecular weight of Methyl 4-Boc-piperazine-2-acetate?
The molecular weight of Methyl 4-Boc-piperazine-2-acetate is 258.15796 g/mol.
Where can I buy Methyl 4-Boc-piperazine-2-acetate?
You can request a quote for Methyl 4-Boc-piperazine-2-acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-Boc-piperazine-2-acetate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-Boc-piperazine-2-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.