![ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate structure](/static/products/799/799780-02-2.png)
ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
TL;DR: ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate (CAS 799780-02-2) is a chemical compound with molecular formula C25H25F3N4O5 and molecular weight 518.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
Also Known As: ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate, ethyl 7-[({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}acetyl)amino]-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate, ethyl 7-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
| Molecular Formula | C25H25F3N4O5 |
|---|---|
| Molecular Weight | 518.18 g/mol |
| LogP | 3.8528 |
| Topological Polar Surface Area | 96.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 518.17773 |
| Heavy Atoms | 37 |
| Complexity | 1331.8438 |
Chemical Identifiers
| CAS Number | 799780-02-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=CC3=C(C=C2N1)OCO3)NC(=O)CN4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F |
Product Overview
ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate (CAS 799780-02-2), with molecular formula C25H25F3N4O5 and molecular weight 518.18 g/mol. IUPAC: ethyl 7-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate.
Chemical Property Profile of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
Property Insights of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate
The XLogP value of 3.8528 indicates that ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate. Following Lipinski's Rule of Five, ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate?
The CAS number of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate is 799780-02-2.
What is the molecular formula of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate?
The molecular formula of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate is C25H25F3N4O5.
What is the molecular weight of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate?
The molecular weight of ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate is 518.18 g/mol.
Where can I buy ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate?
You can request a quote for ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 7-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-5H-[1,3]dioxolo[4,5-f]indole-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.