Trifluperidol
TL;DR: Trifluperidol (CAS 2062-77-3) is a chemical compound with molecular formula C22H24ClF4NO2 and molecular weight 445.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]butan-1-one chloride
Also Known As: Trifluperidol, Trisedil hydrochloride, Trifluperidol HCl, Triperidol (TN), Trisedyl hydrochloride
| Molecular Formula | C22H24ClF4NO2 |
|---|---|
| Molecular Weight | 445.14 g/mol |
| LogP | 0.38 |
| Topological Polar Surface Area | 41.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.14316 |
| Heavy Atoms | 30 |
| Complexity | 537.0 |
Chemical Identifiers
| CAS Number | 2062-77-3 |
|---|---|
| SMILES | C1C[NH+](CCC1(C2=CC(=CC=C2)C(F)(F)F)O)CCCC(=O)C3=CC=C(C=C3)F.[Cl-] |
| InChIKey | VYGQXRZAHIZHQV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trifluperidol (CAS 2062-77-3), with molecular formula C22H24ClF4NO2 and molecular weight 445.14 g/mol. IUPAC: 1-(4-fluorophenyl)-4-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]butan-1-one chloride.
Chemical Property Profile of Trifluperidol
Property Insights of Trifluperidol
The XLogP value of 0.38 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trifluperidol. With a topological polar surface area (TPSA) of 41.7 Ų, Trifluperidol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trifluperidol has 2 hydrogen bond donor(s) and 7 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 Trifluperidol?
The CAS number of Trifluperidol is 2062-77-3.
What is the molecular formula of Trifluperidol?
The molecular formula of Trifluperidol is C22H24ClF4NO2.
What is the molecular weight of Trifluperidol?
The molecular weight of Trifluperidol is 445.14 g/mol.
Where can I buy Trifluperidol?
You can request a quote for Trifluperidol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trifluperidol?
Yes, KEHONG BIO provides custom synthesis services for Trifluperidol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.