![Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate structure](/static/products/401/401604-83-9.png)
Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate
TL;DR: Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate (CAS 401604-83-9) is a chemical compound with molecular formula C19H16BrNO4 and molecular weight 401.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate
Also Known As: methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate, methyl 1-[(4-bromo-3-methylphenoxy)acetyl]-1H-indole-3-carboxylate, methyl 1-(2-(4-bromo-3-methylphenoxy)acetyl)-1H-indole-3-carboxylate, METHYL 1-[2-(4-BROMO-3-METHYLPHENOXY)ACETYL]-1H-INDOLE-3-CARBOXYLATE
| Molecular Formula | C19H16BrNO4 |
|---|---|
| Molecular Weight | 401.03 g/mol |
| LogP | 4.21802 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.02628 |
| Heavy Atoms | 25 |
| Complexity | 961.2125 |
Chemical Identifiers
| CAS Number | 401604-83-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC(=O)N2C=C(C3=CC=CC=C32)C(=O)OC)Br |
Product Overview
Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate (CAS 401604-83-9), with molecular formula C19H16BrNO4 and molecular weight 401.03 g/mol. IUPAC: methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate.
Chemical Property Profile of Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate
Property Insights of Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate
The XLogP value of 4.21802 indicates that Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.53 Ų, Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate has 0 hydrogen bond donor(s) and 4 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 Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate?
The CAS number of Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate is 401604-83-9.
What is the molecular formula of Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate?
The molecular formula of Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate is C19H16BrNO4.
What is the molecular weight of Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate?
The molecular weight of Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate is 401.03 g/mol.
Where can I buy Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate?
You can request a quote for Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]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 Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-[2-(4-bromo-3-methylphenoxy)acetyl]indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.