ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
TL;DR: ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS 840474-14-8) is a chemical compound with molecular formula C23H32N4O6 and molecular weight 460.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate
Also Known As: ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate, ethyl 4-(2-(4-(ethoxycarbonyl)piperazin-1-yl)acetamido)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate, ethyl 4-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate
| Molecular Formula | C23H32N4O6 |
|---|---|
| Molecular Weight | 460.23 g/mol |
| LogP | 2.38462 |
| Topological Polar Surface Area | 102.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.23218 |
| Heavy Atoms | 33 |
| Complexity | 1039.4814 |
Chemical Identifiers
| CAS Number | 840474-14-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)OC)NC(=O)CN3CCN(CC3)C(=O)OCC)C)C |
Product Overview
ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS 840474-14-8), with molecular formula C23H32N4O6 and molecular weight 460.23 g/mol. IUPAC: ethyl 4-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-methoxy-1,2-dimethylindole-3-carboxylate.
Chemical Property Profile of ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
Property Insights of ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
The XLogP value of 2.38462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate. The TPSA of 102.34 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate has 1 hydrogen bond donor(s) and 7 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 ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
The CAS number of ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is 840474-14-8.
What is the molecular formula of ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
The molecular formula of ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is C23H32N4O6.
What is the molecular weight of ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
The molecular weight of ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate is 460.23 g/mol.
Where can I buy ethyl 4-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate?
You can request a quote for ethyl 4-({[4-(ethoxycarbonyl)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-(ethoxycarbonyl)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-(ethoxycarbonyl)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.