Seperidol Hydrochloride
TL;DR: Seperidol Hydrochloride (CAS 17230-87-4) is a chemical compound with molecular formula C22H23Cl2F4NO2 and molecular weight 479.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxypiperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one chloride
Also Known As: Seperol, Seperidol hydrochloride, Seperidol HCl, Clofluperol hydrochloride, Speridol hydrochloride
| Molecular Formula | C22H23Cl2F4NO2 |
|---|---|
| Molecular Weight | 479.10 g/mol |
| LogP | 1.03 |
| Topological Polar Surface Area | 41.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.1042 |
| Heavy Atoms | 31 |
| Complexity | 572.0 |
Chemical Identifiers
| CAS Number | 17230-87-4 |
|---|---|
| SMILES | C1C[NH+](CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)CCCC(=O)C3=CC=C(C=C3)F.[Cl-] |
| InChIKey | MNEIBEWKVRSDEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Seperidol Hydrochloride (CAS 17230-87-4), with molecular formula C22H23Cl2F4NO2 and molecular weight 479.10 g/mol. IUPAC: 4-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxypiperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one chloride.
Chemical Property Profile of Seperidol Hydrochloride
Property Insights of Seperidol Hydrochloride
The XLogP value of 1.03 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Seperidol Hydrochloride. With a topological polar surface area (TPSA) of 41.7 Ų, Seperidol Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Seperidol Hydrochloride 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 Seperidol Hydrochloride?
The CAS number of Seperidol Hydrochloride is 17230-87-4.
What is the molecular formula of Seperidol Hydrochloride?
The molecular formula of Seperidol Hydrochloride is C22H23Cl2F4NO2.
What is the molecular weight of Seperidol Hydrochloride?
The molecular weight of Seperidol Hydrochloride is 479.10 g/mol.
Where can I buy Seperidol Hydrochloride?
You can request a quote for Seperidol Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Seperidol Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Seperidol Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.