methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate
TL;DR: methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate (CAS 844449-57-6) is a chemical compound with molecular formula C24H25F3N4O3 and molecular weight 474.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-methyl-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate
Also Known As: methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate, methyl 6-methyl-3-[({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}acetyl)amino]-1H-indole-2-carboxylate, methyl 6-methyl-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate
| Molecular Formula | C24H25F3N4O3 |
|---|---|
| Molecular Weight | 474.19 g/mol |
| LogP | 4.04242 |
| Topological Polar Surface Area | 77.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.18787 |
| Heavy Atoms | 34 |
| Complexity | 1213.8838 |
Chemical Identifiers
| CAS Number | 844449-57-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate (CAS 844449-57-6), with molecular formula C24H25F3N4O3 and molecular weight 474.19 g/mol. IUPAC: methyl 6-methyl-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate
Property Insights of methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate
The XLogP value of 4.04242 indicates that methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.67 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-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 methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
The CAS number of methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is 844449-57-6.
What is the molecular formula of methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
The molecular formula of methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is C24H25F3N4O3.
What is the molecular weight of methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
The molecular weight of methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is 474.19 g/mol.
Where can I buy methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
You can request a quote for methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-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 methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 6-methyl-3-(2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.