Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate
TL;DR: Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate (CAS 306746-13-4) is a chemical compound with molecular formula C14H16BrNO3 and molecular weight 325.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-1-ethyl-5-hydroxy-2-methylindole-3-carboxylate
Also Known As: BAS 01507706, Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate, ethyl 6-bromo-1-ethyl-5-hydroxy-2-methylindole-3-carboxylate, A0804/0037647, 6-Bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylic acid ethyl ester
| Molecular Formula | C14H16BrNO3 |
|---|---|
| Molecular Weight | 325.03 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 51.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.03137 |
| Heavy Atoms | 19 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 306746-13-4 |
|---|---|
| SMILES | CCN1C(=C(C2=CC(=C(C=C21)Br)O)C(=O)OCC)C |
| InChIKey | WRQASUHYBRSCJR-UHFFFAOYSA-N |
Product Overview
Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate (CAS 306746-13-4), with molecular formula C14H16BrNO3 and molecular weight 325.03 g/mol. IUPAC: ethyl 6-bromo-1-ethyl-5-hydroxy-2-methylindole-3-carboxylate.
Chemical Property Profile of Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate
Property Insights of Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate
The XLogP value of 3.3 indicates that Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.5 Ų, Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-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 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate?
The CAS number of Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate is 306746-13-4.
What is the molecular formula of Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate?
The molecular formula of Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate is C14H16BrNO3.
What is the molecular weight of Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate?
The molecular weight of Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate is 325.03 g/mol.
Where can I buy Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate?
You can request a quote for Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-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 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-bromo-1-ethyl-5-hydroxy-2-methyl-1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.