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Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate
TL;DR: Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate (CAS 111616-91-2) is a chemical compound with molecular formula C20H15NO4 and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate
Also Known As: ethyl 2-methyl-6,11-dioxo-6,11-dihydrobenzo[f]pyrido[1,2-a]indole-12-carboxylate, ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate, AE-641/42121746, F1414-1453, ethyl 14-methyl-2,9-dioxo-11-azatetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-1(10),3,5,7,12,14,16-heptaene-17-carboxylate
| Molecular Formula | C20H15NO4 |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 3.19982 |
| Topological Polar Surface Area | 64.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.1001 |
| Heavy Atoms | 25 |
| Complexity | 1074.7349 |
Chemical Identifiers
| CAS Number | 111616-91-2 |
|---|---|
| SMILES | CCOC(=O)C1=C2C=C(C=CN2C3=C1C(=O)C4=CC=CC=C4C3=O)C |
Product Overview
Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate (CAS 111616-91-2), with molecular formula C20H15NO4 and molecular weight 333.10 g/mol. IUPAC: ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate.
Chemical Property Profile of Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate
Property Insights of Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate
The XLogP value of 3.19982 indicates that Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate 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 Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate?
The CAS number of Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate is 111616-91-2.
What is the molecular formula of Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate?
The molecular formula of Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate is C20H15NO4.
What is the molecular weight of Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate?
The molecular weight of Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate is 333.10 g/mol.
Where can I buy Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate?
You can request a quote for Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-6,11-dioxonaphtho[2,3-b]indolizine-12-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.