![[2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate structure](/static/products/872/872457-99-3.png)
[2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate
TL;DR: [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate (CAS 872457-99-3) is a chemical compound with molecular formula C19H15ClN2O4 and molecular weight 370.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate
Also Known As: [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate|2-oxo-2-{2-oxo-1-azatricyclo[6.3.1.0^{4,12}]dodeca-4(12),5,7-trien-6-yl}ethyl 6-chloropyridine-3-carboxylate|2-oxo-2-{2-oxo-1-azatricyclo[6.3.1.0,4,12]dodeca-4(12),5,7-trien-6-yl}ethyl 6-chloropyridine-3-carboxylate|EN300-26621124
| Molecular Formula | C19H15ClN2O4 |
|---|---|
| Molecular Weight | 370.07 g/mol |
| LogP | 2.61 |
| Topological Polar Surface Area | 76.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.07202 |
| Heavy Atoms | 26 |
| Complexity | 923.88153 |
Chemical Identifiers
| CAS Number | 872457-99-3 |
|---|---|
| SMILES | C1CC2=C3C(=CC(=C2)C(=O)COC(=O)C4=CN=C(C=C4)Cl)CC(=O)N3C1 |
Product Overview
[2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate (CAS 872457-99-3), with molecular formula C19H15ClN2O4 and molecular weight 370.07 g/mol. IUPAC: [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate.
Chemical Property Profile of [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate
Property Insights of [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate
The XLogP value of 2.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate. The TPSA of 76.57 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-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 [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate?
The CAS number of [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate is 872457-99-3.
What is the molecular formula of [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate?
The molecular formula of [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate is C19H15ClN2O4.
What is the molecular weight of [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate?
The molecular weight of [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate is 370.07 g/mol.
Where can I buy [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate?
You can request a quote for [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-oxo-2-(2-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-6-yl)ethyl] 6-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.