Ocinaplon
TL;DR: Ocinaplon (CAS 96604-21-6) is a chemical compound with molecular formula C17H11N5O and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridin-2-yl-(7-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
Also Known As: Ocinaplon, Ocinaplone, ocinaplonum, Ocinaplon [USAN:INN], TEPOXALIN
| Molecular Formula | C17H11N5O |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 73.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.09637 |
| Heavy Atoms | 23 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 96604-21-6 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(=O)C2=C3N=CC=C(N3N=C2)C4=CC=NC=C4 |
| InChIKey | OQJFBUOFGHPMSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ocinaplon (CAS 96604-21-6), with molecular formula C17H11N5O and molecular weight 301.10 g/mol. IUPAC: pyridin-2-yl-(7-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone.
Chemical Property Profile of Ocinaplon
Property Insights of Ocinaplon
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ocinaplon. The TPSA of 73.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ocinaplon. Following Lipinski's Rule of Five, Ocinaplon 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 Ocinaplon?
The CAS number of Ocinaplon is 96604-21-6.
What is the molecular formula of Ocinaplon?
The molecular formula of Ocinaplon is C17H11N5O.
What is the molecular weight of Ocinaplon?
The molecular weight of Ocinaplon is 301.10 g/mol.
Where can I buy Ocinaplon?
You can request a quote for Ocinaplon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ocinaplon?
Yes, KEHONG BIO provides custom synthesis services for Ocinaplon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.