![Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate structure](/static/products/799/799779-93-4.png)
Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate
TL;DR: Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate (CAS 799779-93-4) is a chemical compound with molecular formula C26H31BrN4O3 and molecular weight 526.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate
Also Known As: Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate, ethyl 5-bromo-3-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate, ethyl 5-bromo-3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)propanamido)-1H-indole-2-carboxylate
| Molecular Formula | C26H31BrN4O3 |
|---|---|
| Molecular Weight | 526.16 g/mol |
| LogP | 4.87474 |
| Topological Polar Surface Area | 77.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 526.15796 |
| Heavy Atoms | 34 |
| Complexity | 1198.219 |
Chemical Identifiers
| CAS Number | 799779-93-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CCN3CCN(CC3)C4=CC=CC(=C4C)C |
Product Overview
Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate (CAS 799779-93-4), with molecular formula C26H31BrN4O3 and molecular weight 526.16 g/mol. IUPAC: ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate.
Chemical Property Profile of Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate
Property Insights of Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate
The XLogP value of 4.87474 indicates that Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate has 2 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 Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate?
The CAS number of Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate is 799779-93-4.
What is the molecular formula of Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate?
The molecular formula of Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate is C26H31BrN4O3.
What is the molecular weight of Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate?
The molecular weight of Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate is 526.16 g/mol.
Where can I buy Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate?
You can request a quote for Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-bromo-3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.