Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate
TL;DR: Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate (CAS 1008472-97-6) is a chemical compound with molecular formula C12H20N2O5 and molecular weight 272.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate
Also Known As: ChemDiv3_007287, tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate, IDI1_025197, BRD-A96272097-001-01-9, tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxo-1-piperazinecarboxylate
| Molecular Formula | C12H20N2O5 |
|---|---|
| Molecular Weight | 272.14 g/mol |
| LogP | 0.285 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.1372 |
| Heavy Atoms | 19 |
| Complexity | 374.80624 |
Chemical Identifiers
| CAS Number | 1008472-97-6 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCNC(=O)C1CC(=O)OC |
Product Overview
Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate (CAS 1008472-97-6), with molecular formula C12H20N2O5 and molecular weight 272.14 g/mol. IUPAC: tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate.
Chemical Property Profile of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate
Property Insights of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate
The XLogP value of 0.285 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate. Following Lipinski's Rule of Five, Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate 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
Frequently Asked Questions
What is the CAS number of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate?
The CAS number of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate is 1008472-97-6.
What is the molecular formula of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate?
The molecular formula of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate is C12H20N2O5.
What is the molecular weight of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate?
The molecular weight of Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate is 272.14 g/mol.
Where can I buy Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate?
You can request a quote for Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 2-(2-methoxy-2-oxoethyl)-3-oxopiperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.