Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate
TL;DR: Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate (CAS 369395-06-2) is a chemical compound with molecular formula C20H25FN4O5 and molecular weight 420.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate
Also Known As: Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate, ethyl 3-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-fluoro-1H-indole-2-carboxylate, ethyl 3-(2-(4-(ethoxycarbonyl)piperazin-1-yl)acetamido)-5-fluoro-1H-indole-2-carboxylate
| Molecular Formula | C20H25FN4O5 |
|---|---|
| Molecular Weight | 420.18 g/mol |
| LogP | 2.1963 |
| Topological Polar Surface Area | 103.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.1809 |
| Heavy Atoms | 30 |
| Complexity | 936.6649 |
Chemical Identifiers
| CAS Number | 369395-06-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CN3CCN(CC3)C(=O)OCC |
Product Overview
Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate (CAS 369395-06-2), with molecular formula C20H25FN4O5 and molecular weight 420.18 g/mol. IUPAC: ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate.
Chemical Property Profile of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate
Property Insights of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate
The XLogP value of 2.1963 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate. The TPSA of 103.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-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
Frequently Asked Questions
What is the CAS number of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate?
The CAS number of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate is 369395-06-2.
What is the molecular formula of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate?
The molecular formula of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate is C20H25FN4O5.
What is the molecular weight of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate?
The molecular weight of Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate is 420.18 g/mol.
Where can I buy Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate?
You can request a quote for Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-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 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[[2-(4-ethoxycarbonylpiperazin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.