![Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate structure](/static/products/1650/16503-53-0.webp)
Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
TL;DR: Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate (CAS 16503-53-0) is a chemical compound with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
Also Known As: Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate, J1.096.167J, DIETHYL-2,3-DIAZABICYCLO[2,2,1]HEPT-5-ENE-2,3-DICARBOXYLATE, diethyl 2,3-diazabicyclo(2.2.1)hept-5-ene-2,3-dicarboxylate, Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate #
| Molecular Formula | C11H16N2O4 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.11101 |
| Heavy Atoms | 17 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 16503-53-0 |
|---|---|
| SMILES | CCOC(=O)N1C2CC(N1C(=O)OCC)C=C2 |
| InChIKey | XMAKWQGDHULQOS-UHFFFAOYSA-N |
Product Overview
Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate (CAS 16503-53-0), with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol. IUPAC: diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate.
Chemical Property Profile of Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
Property Insights of Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate. With a topological polar surface area (TPSA) of 59.1 Ų, Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate has 0 hydrogen bond donor(s) and 4 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 Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate?
The CAS number of Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate is 16503-53-0.
What is the molecular formula of Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate?
The molecular formula of Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate is C11H16N2O4.
What is the molecular weight of Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate?
The molecular weight of Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate is 240.11 g/mol.
Where can I buy Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate?
You can request a quote for Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2,3-diazabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.