1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-
TL;DR: 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- (CAS 163064-67-3) is a chemical compound with molecular formula C20H17F3N2O and molecular weight 358.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-1-[2-(3-phenyl-1H-indol-2-yl)pyrrolidin-1-yl]ethanone
Also Known As: 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-, 3-Phenyl-2-[1-(trifluoroacetyl)-2-pyrrolidinyl]-1H-indole #, 2,2,2-trifluoro-1-[2-(3-phenyl-1H-indol-2-yl)pyrrolidin-1-yl]ethanone, (S)-2,2,2-Trifluoro-1-(2-(3-phenyl-1H-indol-2-yl)pyrrolidin-1-yl)ethanone, 2,2,2-trifluoro-1-[(2S)-2-(3-phenyl-1H-indol-2-yl)pyrrolidin-1-yl]ethan-1-one
| Molecular Formula | C20H17F3N2O |
|---|---|
| Molecular Weight | 358.13 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.1293 |
| Heavy Atoms | 26 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 163064-67-3 |
|---|---|
| SMILES | C1CC(N(C1)C(=O)C(F)(F)F)C2=C(C3=CC=CC=C3N2)C4=CC=CC=C4 |
| InChIKey | WAYFMRPVNGHILW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- (CAS 163064-67-3), with molecular formula C20H17F3N2O and molecular weight 358.13 g/mol. IUPAC: 2,2,2-trifluoro-1-[2-(3-phenyl-1H-indol-2-yl)pyrrolidin-1-yl]ethanone.
Chemical Property Profile of 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-
Property Insights of 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-
The XLogP value of 4.6 indicates that 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.1 Ų, 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- has 1 hydrogen bond donor(s) and 4 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 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-?
The CAS number of 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- is 163064-67-3.
What is the molecular formula of 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-?
The molecular formula of 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- is C20H17F3N2O.
What is the molecular weight of 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-?
The molecular weight of 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- is 358.13 g/mol.
Where can I buy 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-?
You can request a quote for 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole, 3-phenyl-2-(1'-trifluoroacetylpyrrolidin-2'-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.