Prinaberel
TL;DR: Prinaberel (CAS 2108968-31-4) is a chemical compound with molecular formula C15H10FNO3 and molecular weight 271.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethenyl-2-(3-fluoro-4-hydroxyphenyl)-1,3-benzoxazol-5-ol
Also Known As: Prinaberel, ERB 041, prinaberelum, Prinaberel [USAN], Prinaberel [USAN:INN]
| Molecular Formula | C15H10FNO3 |
|---|---|
| Molecular Weight | 271.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.06448 |
| Heavy Atoms | 20 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 2108968-31-4 |
|---|---|
| SMILES | C=CC1=C2C(=CC(=C1)O)N=C(O2)C3=CC(=C(C=C3)O)F |
| InChIKey | MQIMZDXIAHJKQP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Prinaberel (CAS 2108968-31-4), with molecular formula C15H10FNO3 and molecular weight 271.06 g/mol. IUPAC: 7-ethenyl-2-(3-fluoro-4-hydroxyphenyl)-1,3-benzoxazol-5-ol.
Chemical Property Profile of Prinaberel
Property Insights of Prinaberel
The XLogP value of 3.6 indicates that Prinaberel is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Prinaberel. Following Lipinski's Rule of Five, Prinaberel has 2 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 Prinaberel?
The CAS number of Prinaberel is 2108968-31-4.
What is the molecular formula of Prinaberel?
The molecular formula of Prinaberel is C15H10FNO3.
What is the molecular weight of Prinaberel?
The molecular weight of Prinaberel is 271.06 g/mol.
Where can I buy Prinaberel?
You can request a quote for Prinaberel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prinaberel?
Yes, KEHONG BIO provides custom synthesis services for Prinaberel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.