3,4,5-Triphenylisoxazole
TL;DR: 3,4,5-Triphenylisoxazole (CAS 22020-72-0) is a chemical compound with molecular formula C21H15NO and molecular weight 297.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-triphenyl-1,2-oxazole
Also Known As: 3,4,5-Triphenylisoxazole, 3,5-Triphenylisoxazole, 3,4,5-triphenyl-1,2-oxazole, Isoxazole,3,4,5-triphenyl-, Isoxazole,4,5-triphenyl-
| Molecular Formula | C21H15NO |
|---|---|
| Molecular Weight | 297.12 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.11536 |
| Heavy Atoms | 23 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 22020-72-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | ZVOMKZHDZNGXPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5-Triphenylisoxazole (CAS 22020-72-0), with molecular formula C21H15NO and molecular weight 297.12 g/mol. IUPAC: 3,4,5-triphenyl-1,2-oxazole.
Chemical Property Profile of 3,4,5-Triphenylisoxazole
Property Insights of 3,4,5-Triphenylisoxazole
The XLogP value of 5.3 indicates that 3,4,5-Triphenylisoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 3,4,5-Triphenylisoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-Triphenylisoxazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4,5-Triphenylisoxazole?
The CAS number of 3,4,5-Triphenylisoxazole is 22020-72-0.
What is the molecular formula of 3,4,5-Triphenylisoxazole?
The molecular formula of 3,4,5-Triphenylisoxazole is C21H15NO.
What is the molecular weight of 3,4,5-Triphenylisoxazole?
The molecular weight of 3,4,5-Triphenylisoxazole is 297.12 g/mol.
Where can I buy 3,4,5-Triphenylisoxazole?
You can request a quote for 3,4,5-Triphenylisoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-Triphenylisoxazole?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-Triphenylisoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.