![ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate structure](/static/products/799/799806-47-6.webp)
ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
TL;DR: ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate (CAS 799806-47-6) is a chemical compound with molecular formula C21H28N4O5 and molecular weight 416.20596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-[3-(4-ethoxycarbonylpiperazin-1-yl)propanoylamino]-1H-indole-2-carboxylate
Also Known As: ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate, ethyl 3-(3-(4-(ethoxycarbonyl)piperazin-1-yl)propanamido)-1H-indole-2-carboxylate, ethyl 3-[3-(4-ethoxycarbonylpiperazin-1-yl)propanoylamino]-1H-indole-2-carboxylate
Technical Specifications
| Molecular Formula | C21H28N4O5 |
| Molecular Weight | 416.20596 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 416.20596 Da |
| Heavy Atoms | 30 |
| Complexity | 608.0 |
| SMILES | CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CCN3CCN(CC3)C(=O)OCC |
| InChIKey | SMCFDEGCRUWHGC-UHFFFAOYSA-N |
Chemical Property Profile of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Property Insights of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
The CAS number of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate is 799806-47-6.
What is the molecular formula of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
The molecular formula of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate is C21H28N4O5.
What is the molecular weight of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
The molecular weight of ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate is 416.20596 g/mol.
Where can I buy ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
You can request a quote for ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for ethyl 3-({3-[4-(ethoxycarbonyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.