Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate
TL;DR: Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate (CAS 292855-71-1) is a chemical compound with molecular formula C19H20N2O6 and molecular weight 372.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-(1,3-benzodioxol-5-yl)-5-methyl-8-nitro-1,2,3,7-tetrahydroindolizine-6-carboxylate
Also Known As: Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate, ethyl 7-(1,3-benzodioxol-5-yl)-5-methyl-8-nitro-1,2,3,7-tetrahydroindolizine-6-carboxylate, ethyl 7-(1,3-benzodioxol-5-yl)-8-nitro-5-methyl-1,2,3,7-tetrahydro-6-indolizinecarboxylate, ETHYL 7-(2H-1,3-BENZODIOXOL-5-YL)-5-METHYL-8-NITRO-1,2,3,7-TETRAHYDROINDOLIZINE-6-CARBOXYLATE
| Molecular Formula | C19H20N2O6 |
|---|---|
| Molecular Weight | 372.13 g/mol |
| LogP | 2.9337 |
| Topological Polar Surface Area | 91.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.13214 |
| Heavy Atoms | 27 |
| Complexity | 888.1861 |
Chemical Identifiers
| CAS Number | 292855-71-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N2CCCC2=C(C1C3=CC4=C(C=C3)OCO4)[N+](=O)[O-])C |
Product Overview
Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate (CAS 292855-71-1), with molecular formula C19H20N2O6 and molecular weight 372.13 g/mol. IUPAC: ethyl 7-(1,3-benzodioxol-5-yl)-5-methyl-8-nitro-1,2,3,7-tetrahydroindolizine-6-carboxylate.
Chemical Property Profile of Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate
Property Insights of Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate
The XLogP value of 2.9337 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate. The TPSA of 91.14 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate. Following Lipinski's Rule of Five, Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate has 0 hydrogen bond donor(s) and 7 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 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate?
The CAS number of Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate is 292855-71-1.
What is the molecular formula of Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate?
The molecular formula of Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate is C19H20N2O6.
What is the molecular weight of Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate?
The molecular weight of Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate is 372.13 g/mol.
Where can I buy Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate?
You can request a quote for Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 7-(1,3-benzodioxol-5-yl)-1,2,3,7-tetrahydro-5-methyl-8-nitro-6-indolizinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.