ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate
TL;DR: ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate (CAS 397880-95-4) is a chemical compound with molecular formula C25H22BrNO4 and molecular weight 479.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenylindole-3-carboxylate
Also Known As: ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate, Ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-indole-3-carboxylate, ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenylindole-3-carboxylate
| Molecular Formula | C25H22BrNO4 |
|---|---|
| Molecular Weight | 479.07 g/mol |
| LogP | 6.1573 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 479.0732 |
| Heavy Atoms | 31 |
| Complexity | 1202.9094 |
Chemical Identifiers
| CAS Number | 397880-95-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)COC4=CC=CC=C4 |
Product Overview
ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate (CAS 397880-95-4), with molecular formula C25H22BrNO4 and molecular weight 479.07 g/mol. IUPAC: ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenylindole-3-carboxylate.
Chemical Property Profile of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate
Property Insights of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate
The XLogP value of 6.1573 indicates that ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-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 49.69 Ų, ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate?
The CAS number of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate is 397880-95-4.
What is the molecular formula of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate?
The molecular formula of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate is C25H22BrNO4.
What is the molecular weight of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate?
The molecular weight of ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate is 479.07 g/mol.
Where can I buy ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate?
You can request a quote for ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-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 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 6-bromo-5-methoxy-2-(phenoxymethyl)-1-phenyl-1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.