Anisopirol
TL;DR: Anisopirol (CAS 857-62-5) is a chemical compound with molecular formula C21H27FN2O2 and molecular weight 358.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-ol
Also Known As: Anisopirol, Haloisol, Anisopirolum, Amisopirol, Anisopirol [INN]
| Molecular Formula | C21H27FN2O2 |
|---|---|
| Molecular Weight | 358.21 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.20566 |
| Heavy Atoms | 26 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 857-62-5 |
|---|---|
| SMILES | COC1=CC=CC=C1N2CCN(CC2)CCCC(C3=CC=C(C=C3)F)O |
| InChIKey | LCZRXFYSMJIDQQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Anisopirol (CAS 857-62-5), with molecular formula C21H27FN2O2 and molecular weight 358.21 g/mol. IUPAC: 1-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-ol.
Chemical Property Profile of Anisopirol
Property Insights of Anisopirol
The XLogP value of 3.5 indicates that Anisopirol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, Anisopirol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anisopirol has 1 hydrogen bond donor(s) and 5 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 Anisopirol?
The CAS number of Anisopirol is 857-62-5.
What is the molecular formula of Anisopirol?
The molecular formula of Anisopirol is C21H27FN2O2.
What is the molecular weight of Anisopirol?
The molecular weight of Anisopirol is 358.21 g/mol.
Where can I buy Anisopirol?
You can request a quote for Anisopirol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anisopirol?
Yes, KEHONG BIO provides custom synthesis services for Anisopirol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.