ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate
TL;DR: ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate (CAS 879447-83-3) is a chemical compound with molecular formula C24H28N2O8 and molecular weight 472.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate
| Molecular Formula | C24H28N2O8 |
|---|---|
| Molecular Weight | 472.18 g/mol |
| LogP | 3.0458 |
| Topological Polar Surface Area | 125.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 472.18457 |
| Heavy Atoms | 34 |
| Complexity | 1027.4086 |
Chemical Identifiers
| CAS Number | 879447-83-3 |
|---|---|
| SMILES | CCOC(=O)C1CCN2C(C1)C3(CC4=C2C=CC(=C4)[N+](=O)[O-])C(=O)OC5(CCCCC5)OC3=O |
Product Overview
ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate (CAS 879447-83-3), with molecular formula C24H28N2O8 and molecular weight 472.18 g/mol.
Chemical Property Profile of ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate
Property Insights of ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate
The XLogP value of 3.0458 indicates that ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.28 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate. Following Lipinski's Rule of Five, ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate has 0 hydrogen bond donor(s) and 9 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 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate?
The CAS number of ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate is 879447-83-3.
What is the molecular formula of ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate?
The molecular formula of ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate is C24H28N2O8.
What is the molecular weight of ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate?
The molecular weight of ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate is 472.18 g/mol.
Where can I buy ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate?
You can request a quote for ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 8''-nitro-4',6'-dioxo-2'',3'',4'',4a''-tetrahydro-1''H,6''H-dispiro[cyclohexane-1,2'-[1,3]dioxane-5',5''-pyrido[1,2-a]quinoline]-3''-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.