![{2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate structure](/static/products/5418/54186-33-3.webp)
{2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate
TL;DR: {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate (CAS 54186-33-3) is a chemical compound with molecular formula C25H20Cl3NO3 and molecular weight 487.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(2,4-dichlorophenoxy)methyl]-1-ethylindol-3-yl]methyl 3-chlorobenzoate
Also Known As: [2-[(2,4-dichlorophenoxy)methyl]-1-ethylindol-3-yl]methyl 3-|{2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate|[2-[(2,4-dichlorophenoxy)methyl]-1-ethylindol-3-yl]methyl 3-chlorobenzoate
| Molecular Formula | C25H20Cl3NO3 |
|---|---|
| Molecular Weight | 487.05 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 487.05087 |
| Heavy Atoms | 32 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 54186-33-3 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2C(=C1COC3=C(C=C(C=C3)Cl)Cl)COC(=O)C4=CC(=CC=C4)Cl |
| InChIKey | OCTCTWDCOSSLBB-UHFFFAOYSA-N |
Product Overview
{2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate (CAS 54186-33-3), with molecular formula C25H20Cl3NO3 and molecular weight 487.05 g/mol. IUPAC: [2-[(2,4-dichlorophenoxy)methyl]-1-ethylindol-3-yl]methyl 3-chlorobenzoate.
Chemical Property Profile of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate
Property Insights of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate
The XLogP value of 7.0 indicates that {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate?
The CAS number of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate is 54186-33-3.
What is the molecular formula of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate?
The molecular formula of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate is C25H20Cl3NO3.
What is the molecular weight of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate?
The molecular weight of {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate is 487.05 g/mol.
Where can I buy {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate?
You can request a quote for {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for {2-[(2,4-Dichlorophenoxy)methyl]-1-ethyl-1H-indol-3-yl}methyl 3-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.