ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate
TL;DR: ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate (CAS 714944-08-8) is a chemical compound with molecular formula C26H31N5O6 and molecular weight 509.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methoxy-1,2-dimethyl-4-[[2-[4-(4-nitrophenyl)piperazin-1-yl]acetyl]amino]indole-3-carboxylate
Also Known As: ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate, ethyl 5-methoxy-1,2-dimethyl-4-(2-(4-(4-nitrophenyl)piperazin-1-yl)acetamido)-1H-indole-3-carboxylate, ethyl 5-methoxy-1,2-dimethyl-4-[[2-[4-(4-nitrophenyl)piperazin-1-yl]acetyl]amino]indole-3-carboxylate
| Molecular Formula | C26H31N5O6 |
|---|---|
| Molecular Weight | 509.23 g/mol |
| LogP | 3.34092 |
| Topological Polar Surface Area | 119.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 509.22745 |
| Heavy Atoms | 37 |
| Complexity | 1325.7161 |
Chemical Identifiers
| CAS Number | 714944-08-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)NC(=O)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C)C |
Product Overview
ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate (CAS 714944-08-8), with molecular formula C26H31N5O6 and molecular weight 509.23 g/mol. IUPAC: ethyl 5-methoxy-1,2-dimethyl-4-[[2-[4-(4-nitrophenyl)piperazin-1-yl]acetyl]amino]indole-3-carboxylate.
Chemical Property Profile of ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate
Property Insights of ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate
The XLogP value of 3.34092 indicates that ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.18 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate has 1 hydrogen bond donor(s) and 8 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-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate?
The CAS number of ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate is 714944-08-8.
What is the molecular formula of ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate?
The molecular formula of ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate is C26H31N5O6.
What is the molecular weight of ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate?
The molecular weight of ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate is 509.23 g/mol.
Where can I buy ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate?
You can request a quote for ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-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 ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-methoxy-1,2-dimethyl-4-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.