Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate
TL;DR: Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate (CAS 5564-29-4) is a chemical compound with molecular formula C18H17NO3 and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-hydroxy-2-methyl-1-phenylindole-3-carboxylate
Also Known As: Oksifemedol, OXYPHEMEDOL, Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate, Maybridge1_002110, BTB 12991
| Molecular Formula | C18H17NO3 |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 51.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.12085 |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 5564-29-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)C3=CC=CC=C3)C |
| InChIKey | FXHQPYDEYABRMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate (CAS 5564-29-4), with molecular formula C18H17NO3 and molecular weight 295.12 g/mol. IUPAC: ethyl 5-hydroxy-2-methyl-1-phenylindole-3-carboxylate.
Chemical Property Profile of Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate
Property Insights of Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate
The XLogP value of 3.9 indicates that Ethyl 5-hydroxy-2-methyl-1-phenyl-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 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-hydroxy-2-methyl-1-phenyl-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 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate?
The CAS number of Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate is 5564-29-4.
What is the molecular formula of Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate?
The molecular formula of Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate is C18H17NO3.
What is the molecular weight of Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate?
The molecular weight of Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate is 295.12 g/mol.
Where can I buy Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate?
You can request a quote for Ethyl 5-hydroxy-2-methyl-1-phenyl-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 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-hydroxy-2-methyl-1-phenyl-1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.