Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate
TL;DR: Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate (CAS 373614-23-4) is a chemical compound with molecular formula C21H20N2O6 and molecular weight 396.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate
Also Known As: ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate, ethyl 1-ethyl-2-methyl-5-((4-nitrobenzoyl)oxy)-1H-indole-3-carboxylate, ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyloxy)-1H-indole-3-carboxylate, 1-Ethyl-2-methyl-5-(4-nitro-benzoyloxy)-1H-indole-3-carboxylic acid ethyl ester, ethyl 1-ethyl-2-methyl-5-{[(4-nitrophenyl)carbonyl]oxy}-1H-indole-3-carboxylate
| Molecular Formula | C21H20N2O6 |
|---|---|
| Molecular Weight | 396.13 g/mol |
| LogP | 4.27372 |
| Topological Polar Surface Area | 100.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.13214 |
| Heavy Atoms | 29 |
| Complexity | 1098.552 |
Chemical Identifiers
| CAS Number | 373614-23-4 |
|---|---|
| SMILES | CCN1C(=C(C2=C1C=CC(=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCC)C |
Product Overview
Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate (CAS 373614-23-4), with molecular formula C21H20N2O6 and molecular weight 396.13 g/mol. IUPAC: ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate.
Chemical Property Profile of Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate
Property Insights of Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate
The XLogP value of 4.27372 indicates that Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate has 0 hydrogen bond donor(s) and 6 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 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate?
The CAS number of Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate is 373614-23-4.
What is the molecular formula of Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate?
The molecular formula of Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate is C21H20N2O6.
What is the molecular weight of Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate?
The molecular weight of Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate is 396.13 g/mol.
Where can I buy Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate?
You can request a quote for Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-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 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-ethyl-2-methyl-5-(4-nitrobenzoyl)oxyindole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.