![ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate structure](/static/products/873/873857-18-2.png)
ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate
TL;DR: ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate (CAS 873857-18-2) is a chemical compound with molecular formula C17H26N2O5 and molecular weight 338.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)piperazine-1-carboxylate
Also Known As: ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate, ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptyl)carbonyl]piperazinec arboxylate, ethyl 4-(1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carbonyl)piperazine-1-carboxylate, ethyl 4-(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)piperazine-1-carboxylate
| Molecular Formula | C17H26N2O5 |
|---|---|
| Molecular Weight | 338.18 g/mol |
| LogP | 1.409 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.18417 |
| Heavy Atoms | 24 |
| Complexity | 581.52997 |
Chemical Identifiers
| CAS Number | 873857-18-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)C23CCC(C2(C)C)(C(=O)O3)C |
Product Overview
ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate (CAS 873857-18-2), with molecular formula C17H26N2O5 and molecular weight 338.18 g/mol. IUPAC: ethyl 4-(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate
Property Insights of ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate
The XLogP value of 1.409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate has 0 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 ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate?
The CAS number of ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate is 873857-18-2.
What is the molecular formula of ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate?
The molecular formula of ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate is C17H26N2O5.
What is the molecular weight of ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate?
The molecular weight of ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate is 338.18 g/mol.
Where can I buy ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate?
You can request a quote for ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.