Piroctone
TL;DR: Piroctone (CAS 50650-76-5) is a chemical compound with molecular formula C14H23NO2 and molecular weight 237.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)pyridin-2-one
Also Known As: Piroctone, Piroctona, Piroctonum, Piroctonol, Octopirox
| Molecular Formula | C14H23NO2 |
|---|---|
| Molecular Weight | 237.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.17288 |
| Heavy Atoms | 17 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 50650-76-5 |
|---|---|
| SMILES | CC1=CC(=O)N(C(=C1)CC(C)CC(C)(C)C)O |
| InChIKey | OIQJEQLSYJSNDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piroctone (CAS 50650-76-5), with molecular formula C14H23NO2 and molecular weight 237.17 g/mol. IUPAC: 1-hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)pyridin-2-one.
Chemical Property Profile of Piroctone
Property Insights of Piroctone
The XLogP value of 3.1 indicates that Piroctone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Piroctone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piroctone has 1 hydrogen bond donor(s) and 2 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 Piroctone?
The CAS number of Piroctone is 50650-76-5.
What is the molecular formula of Piroctone?
The molecular formula of Piroctone is C14H23NO2.
What is the molecular weight of Piroctone?
The molecular weight of Piroctone is 237.17 g/mol.
Where can I buy Piroctone?
You can request a quote for Piroctone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piroctone?
Yes, KEHONG BIO provides custom synthesis services for Piroctone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.