5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole
TL;DR: 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole (CAS 56327-82-3) is a chemical compound with molecular formula C30H30BrNO5 and molecular weight 563.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole
Also Known As: 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole, 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-, 5-Bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-yn-1-yl]-2-[(4-methoxyphenoxy)methyl]-1H-indole
| Molecular Formula | C30H30BrNO5 |
|---|---|
| Molecular Weight | 563.13 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 563.13074 |
| Heavy Atoms | 37 |
| Complexity | 724.0 |
Chemical Identifiers
| CAS Number | 56327-82-3 |
|---|---|
| SMILES | CCOCC1=C(N(C2=C1C=C(C=C2)Br)CC#CCOC3=CC=C(C=C3)OC)COC4=CC=C(C=C4)OC |
| InChIKey | KRYQBISPUXNKCZ-UHFFFAOYSA-N |
Product Overview
5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole (CAS 56327-82-3), with molecular formula C30H30BrNO5 and molecular weight 563.13 g/mol. IUPAC: 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole.
Chemical Property Profile of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole
Property Insights of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole
The XLogP value of 6.0 indicates that 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole?
The CAS number of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole is 56327-82-3.
What is the molecular formula of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole?
The molecular formula of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole is C30H30BrNO5.
What is the molecular weight of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole?
The molecular weight of 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole is 563.13 g/mol.
Where can I buy 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole?
You can request a quote for 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-3-(ethoxymethyl)-1-[4-(4-methoxyphenoxy)but-2-ynyl]-2-[(4-methoxyphenoxy)methyl]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.