Boxidine
TL;DR: Boxidine (CAS 10355-14-3) is a chemical compound with molecular formula C19H20F3NO and molecular weight 335.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[4-[4-(trifluoromethyl)phenyl]phenoxy]ethyl]pyrrolidine
Also Known As: Boxidine, Boxidinum, Boxidina, Boxidin, Boxidine (USAN)
| Molecular Formula | C19H20F3NO |
|---|---|
| Molecular Weight | 335.15 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.1497 |
| Heavy Atoms | 24 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 10355-14-3 |
|---|---|
| SMILES | C1CCN(C1)CCOC2=CC=C(C=C2)C3=CC=C(C=C3)C(F)(F)F |
| InChIKey | FOCUKKUAGZPPCU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Boxidine (CAS 10355-14-3), with molecular formula C19H20F3NO and molecular weight 335.15 g/mol. IUPAC: 1-[2-[4-[4-(trifluoromethyl)phenyl]phenoxy]ethyl]pyrrolidine.
Chemical Property Profile of Boxidine
Property Insights of Boxidine
The XLogP value of 4.9 indicates that Boxidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Boxidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Boxidine has 0 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 Boxidine?
The CAS number of Boxidine is 10355-14-3.
What is the molecular formula of Boxidine?
The molecular formula of Boxidine is C19H20F3NO.
What is the molecular weight of Boxidine?
The molecular weight of Boxidine is 335.15 g/mol.
Where can I buy Boxidine?
You can request a quote for Boxidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boxidine?
Yes, KEHONG BIO provides custom synthesis services for Boxidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.