ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate
TL;DR: ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate (CAS 16381-43-4) is a chemical compound with molecular formula C14H17NO3 and molecular weight 247.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate
Also Known As: ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate, indole, Ethyl 5-Ethoxy-3-Methyl-2-Indolecarboxylate, J1.056.255D, ethyl5-ethoxy-3-methyl-1H-indole-2-carboxylate
| Molecular Formula | C14H17NO3 |
|---|---|
| Molecular Weight | 247.12 g/mol |
| LogP | 3.05172 |
| Topological Polar Surface Area | 51.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.12085 |
| Heavy Atoms | 18 |
| Complexity | 571.66797 |
Chemical Identifiers
| CAS Number | 16381-43-4 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)NC(=C2C)C(=O)OCC |
Product Overview
ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate (CAS 16381-43-4), with molecular formula C14H17NO3 and molecular weight 247.12 g/mol. IUPAC: ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate.
Chemical Property Profile of ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate
Property Insights of ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate
The XLogP value of 3.05172 indicates that ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.32 Ų, ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate has 1 hydrogen bond donor(s) and 3 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-methyl-1H-indole-2-carboxylate?
The CAS number of ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate is 16381-43-4.
What is the molecular formula of ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate?
The molecular formula of ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate is C14H17NO3.
What is the molecular weight of ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate?
The molecular weight of ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate is 247.12 g/mol.
Where can I buy ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate?
You can request a quote for ethyl 5-ethoxy-3-methyl-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-methyl-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-ethoxy-3-methyl-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.