Flupentixol Dihydrochloride
TL;DR: Flupentixol Dihydrochloride (CAS 51529-01-2) is a chemical compound with molecular formula C23H27Cl2F3N2OS and molecular weight 506.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3Z)-3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol;dihydrochloride
Also Known As: Emergil, Flupenthixol dihydrochloride, Flupentixol HCl, FLUPENTIXOL DIHYDROCHLORIDE, Metamin
| Molecular Formula | C23H27Cl2F3N2OS |
|---|---|
| Molecular Weight | 506.12 g/mol |
| LogP | 5.4453 |
| Topological Polar Surface Area | 26.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 506.1173 |
| Heavy Atoms | 32 |
| Complexity | 931.69775 |
Chemical Identifiers
| CAS Number | 51529-01-2 |
|---|---|
| SMILES | C1CN(CCN1CC/C=C\2/C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO.Cl.Cl |
Product Overview
Flupentixol Dihydrochloride (CAS 51529-01-2), with molecular formula C23H27Cl2F3N2OS and molecular weight 506.12 g/mol. IUPAC: 2-[4-[(3Z)-3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol;dihydrochloride.
Chemical Property Profile of Flupentixol Dihydrochloride
Property Insights of Flupentixol Dihydrochloride
The XLogP value of 5.4453 indicates that Flupentixol Dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.71 Ų, Flupentixol Dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Flupentixol Dihydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Flupentixol Dihydrochloride?
The CAS number of Flupentixol Dihydrochloride is 51529-01-2.
What is the molecular formula of Flupentixol Dihydrochloride?
The molecular formula of Flupentixol Dihydrochloride is C23H27Cl2F3N2OS.
What is the molecular weight of Flupentixol Dihydrochloride?
The molecular weight of Flupentixol Dihydrochloride is 506.12 g/mol.
Where can I buy Flupentixol Dihydrochloride?
You can request a quote for Flupentixol Dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Flupentixol Dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Flupentixol Dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.