![ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate structure](/static/products/840/840463-08-3.png)
ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
TL;DR: ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS 840463-08-3) is a chemical compound with molecular formula C27H33ClN4O4 and molecular weight 512.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate
Also Known As: ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate, ethyl 4-(2-(4-(5-chloro-2-methylphenyl)piperazin-1-yl)acetamido)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate, ethyl 4-[[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate
| Molecular Formula | C27H33ClN4O4 |
|---|---|
| Molecular Weight | 512.22 g/mol |
| LogP | 4.39454 |
| Topological Polar Surface Area | 76.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 512.21906 |
| Heavy Atoms | 36 |
| Complexity | 1294.901 |
Chemical Identifiers
| CAS Number | 840463-08-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)NC(=O)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C)C |
Product Overview
ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS 840463-08-3), with molecular formula C27H33ClN4O4 and molecular weight 512.22 g/mol. IUPAC: ethyl 4-[[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate.
Chemical Property Profile of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
Property Insights of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
The XLogP value of 4.39454 indicates that ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.04 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
The CAS number of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is 840463-08-3.
What is the molecular formula of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
The molecular formula of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is C27H33ClN4O4.
What is the molecular weight of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
The molecular weight of ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is 512.22 g/mol.
Where can I buy ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
You can request a quote for ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-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 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.