Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate
TL;DR: Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate (CAS 370844-81-8) is a chemical compound with molecular formula C20H27FN4O3 and molecular weight 390.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate
Also Known As: Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate, ethyl 3-(2-(4-ethylpiperazin-1-yl)propanamido)-5-fluoro-1H-indole-2-carboxylate, ethyl 3-{[2-(4-ethylpiperazin-1-yl)propanoyl]amino}-5-fluoro-1H-indole-2-carboxylate
| Molecular Formula | C20H27FN4O3 |
|---|---|
| Molecular Weight | 390.21 g/mol |
| LogP | 2.4482 |
| Topological Polar Surface Area | 77.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.20673 |
| Heavy Atoms | 28 |
| Complexity | 858.498 |
Chemical Identifiers
| CAS Number | 370844-81-8 |
|---|---|
| SMILES | CCN1CCN(CC1)C(C)C(=O)NC2=C(NC3=C2C=C(C=C3)F)C(=O)OCC |
Product Overview
Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate (CAS 370844-81-8), with molecular formula C20H27FN4O3 and molecular weight 390.21 g/mol. IUPAC: ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate.
Chemical Property Profile of Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate
Property Insights of Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate
The XLogP value of 2.4482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate. The TPSA of 77.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 5 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-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate?
The CAS number of Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate is 370844-81-8.
What is the molecular formula of Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate?
The molecular formula of Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate is C20H27FN4O3.
What is the molecular weight of Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate?
The molecular weight of Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate is 390.21 g/mol.
Where can I buy Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate?
You can request a quote for Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-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-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[2-(4-ethylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.