Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate
TL;DR: Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (CAS 107890-99-3) is a chemical compound with molecular formula C14H15NO4 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate
Also Known As: Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate, 1h-indole-2-carboxylic acid,5-ethoxy-3-formyl-,ethyl ester, ethyl5-ethoxy-3-formyl-1H-indole-2-carboxylate
| Molecular Formula | C14H15NO4 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 2.5558 |
| Topological Polar Surface Area | 68.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.1001 |
| Heavy Atoms | 19 |
| Complexity | 615.17865 |
Chemical Identifiers
| CAS Number | 107890-99-3 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)NC(=C2C=O)C(=O)OCC |
Product Overview
Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate (CAS 107890-99-3), with molecular formula C14H15NO4 and molecular weight 261.10 g/mol. IUPAC: ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate.
Chemical Property Profile of Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate
Property Insights of Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate
The XLogP value of 2.5558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate. The TPSA of 68.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate has 1 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 5-ethoxy-3-formyl-1H-indole-2-carboxylate?
The CAS number of Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate is 107890-99-3.
What is the molecular formula of Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate?
The molecular formula of Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate is C14H15NO4.
What is the molecular weight of Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate?
The molecular weight of Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate is 261.10 g/mol.
Where can I buy Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate?
You can request a quote for Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-ethoxy-3-formyl-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.