1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE
TL;DR: 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE (CAS 874671-31-5) is a chemical compound with molecular formula C20H18ClF3N4O and molecular weight 422.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-(1H-indol-3-yl)ethanone
Also Known As: 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE, 1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(1H-indol-3-yl)ethanone, 1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-2-(1H-indol-3-yl)ethanone, 1-(4-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)piperazin-1-yl)-2-(1H-indol-3-yl)ethan-1-one, 1-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}-2-(1H-indol-3-yl)ethan-1-one
| Molecular Formula | C20H18ClF3N4O |
|---|---|
| Molecular Weight | 422.11 g/mol |
| LogP | 4.1264 |
| Topological Polar Surface Area | 52.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.11212 |
| Heavy Atoms | 29 |
| Complexity | 1041.6274 |
Chemical Identifiers
| CAS Number | 874671-31-5 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)CC3=CNC4=CC=CC=C43 |
Product Overview
1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE (CAS 874671-31-5), with molecular formula C20H18ClF3N4O and molecular weight 422.11 g/mol. IUPAC: 1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-(1H-indol-3-yl)ethanone.
Chemical Property Profile of 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE
Property Insights of 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE
The XLogP value of 4.1264 indicates that 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.23 Ų, 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE has 1 hydrogen bond donor(s) and 3 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 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE?
The CAS number of 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE is 874671-31-5.
What is the molecular formula of 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE?
The molecular formula of 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE is C20H18ClF3N4O.
What is the molecular weight of 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE?
The molecular weight of 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE is 422.11 g/mol.
Where can I buy 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE?
You can request a quote for 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.