Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate
TL;DR: Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate (CAS 405156-87-8) is a chemical compound with molecular formula C22H25BrN2O3 and molecular weight 444.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate
Also Known As: ChemDiv1_009423, BRD-K47153242-001-01-3, ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate, ethyl 6-bromo-2-[(diethylamino)methyl]-5-hydroxy-1-phenyl-1H-indole-3-carboxylate, ethyl 6-bromo-2-((diethylamino)methyl)-5-hydroxy-1-phenyl-1H-indole-3-carboxylate
| Molecular Formula | C22H25BrN2O3 |
|---|---|
| Molecular Weight | 444.10 g/mol |
| LogP | 5.1171 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.10486 |
| Heavy Atoms | 28 |
| Complexity | 978.6057 |
Chemical Identifiers
| CAS Number | 405156-87-8 |
|---|---|
| SMILES | CCN(CC)CC1=C(C2=CC(=C(C=C2N1C3=CC=CC=C3)Br)O)C(=O)OCC |
Product Overview
Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate (CAS 405156-87-8), with molecular formula C22H25BrN2O3 and molecular weight 444.10 g/mol. IUPAC: ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate.
Chemical Property Profile of Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate
Property Insights of Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate
The XLogP value of 5.1171 indicates that Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.7 Ų, Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate has 1 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-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate?
The CAS number of Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate is 405156-87-8.
What is the molecular formula of Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate?
The molecular formula of Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate is C22H25BrN2O3.
What is the molecular weight of Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate?
The molecular weight of Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate is 444.10 g/mol.
Where can I buy Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate?
You can request a quote for Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-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-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 6-bromo-2-(diethylaminomethyl)-5-hydroxy-1-phenylindole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.