112559-91-8

Basic information

• Product Name: HYDROXY ITRACONAZOLE
• Synonyms: HYDROXY ITRACONAZOLE;3H-1,2,4-Triazol-3-one, 4-4-4-4-2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-ylmethoxyphenyl-1-piperazinylphenyl-2,4-dihydro-2-(2-hydroxy-1-methylpropyl)-;4-[4-[4-[4-[[2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-2,4-dihydro-2-(2-hydroxy-1-methylpropyl)-3H-1,2,4-triazol-3-one;R 63373;4-[4-[4-[4-[[2-(2,4-Dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylMethyl)-1,3-dioxolan-4-yl]Methoxy]phenyl]-1-piperazinyl]phenyl]-2,4-dihydro-2-(2-hydroxy-1-Methylpropyl)-;Itraconazole 2-Hydroxy Metabolite;Itraconazole metabolite Hydroxy Itraconazole;Itraconazole Impurity 1
• CAS NO: 112559-91-8
• Molecular Formula: C35H40Cl2N8O4
• Molecular Weight: 707.65
• Product Categories: Various Metabolites and Impurities;Intermediates & Fine Chemicals;Metabolites & Impurities;Pharmaceuticals;Isotooe labelled metabolites;metabolites;Isotopically Labeled Pharmaceutical Reference Standard
• Mol File: 112559-91-8.mol
• Article Data: 0

Chemical Properties

• Melting Point: 76-78°C
• Boiling Point: 884.7°Cat760mmHg
• Flash Point: 488.8°C
• Appearance: /
• Density: 1.44g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.687
• Storage Temp.: -20°C Freezer
• Solubility: Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
• PKA: 14.72±0.20(Predicted)
• CAS DataBase Reference: HYDROXY ITRACONAZOLE(CAS DataBase Reference)
• NIST Chemistry Reference: HYDROXY ITRACONAZOLE(112559-91-8)
• EPA Substance Registry System: HYDROXY ITRACONAZOLE(112559-91-8)

Safety Data

• Hazardous Substances Data: 112559-91-8(Hazardous Substances Data)

Usage

Description

Hydroxy itraconazole (OH-ITZ) is an active metabolite of the antifungal agent itraconazole . Itraconazole is metabolized by the cytochrome P450 isoform 3A4 (CYP3A4) to form hydroxy itraconazole. Hydroxy itraconazole exhibits in vitro antifungal activity (MIC = 0.019, 0.078, and 0.078 mg/ml against C. albicans, A. fumigatus, and C. neoformans, respectively). Plasma concentration of hydroxy itraconazole is directly correlated to that of the parent compound and is used as an indicator of prophylaxis for fungal infections.

Chemical Properties

Off-White Crystalline Solid

Uses

Different sources of media describe the Uses of 112559-91-8 differently. You can refer to the following data:
1. A metabolite of Itraconazole, an orally active antimycotic structurally related to Ketoconazole
2. A metabolite of Itraconazole, an orally active antimycotic structurally related to Ketoconazole. It is a COVID19-related research product.

InChI:InChI=1/C35H38Cl2N8O5/c1-24(25(2)46)45-34(47)44(23-40-45)29-6-4-27(5-7-29)41-13-15-42(16-14-41)28-8-10-30(11-9-28)48-18-31-19-49-35(50-31,20-43-22-38-21-39-43)32-12-3-26(36)17-33(32)37/h3-12,17,21-25,31,46H,13-16,18-20H2,1-2H3/t24?,25?,31-,35-/m0/s1

Related news

A simple, sensitive HPLC-PDA method for the quantification of itraconazole and HYDROXY ITRACONAZOLE (cas 112559-91-8) in human serum: a reference laboratory experience07/25/2019

A chromatographic method (high-performance liquid chromatography/photodiode array detection) for the simultaneous determination of itraconazole and its mayor metabolite, hydroxy itraconazole, was developed. The validation data demonstrated acceptable values for linearity (dynamic range between 0...detailed

Ultra-performance liquid chromatography electrospray ionization–tandem mass spectrometry method for the simultaneous determination of itraconazole and HYDROXY ITRACONAZOLE (cas 112559-91-8) in human plasma07/24/2019

A highly sensitive, selective, and precise ultra-performance liquid chromatography tandem mass spectrometry method was developed and validated for simultaneous quantification of itraconazole and hydroxy itraconazole in human plasma by a single liquid–liquid extraction step. The precursor to pro...detailed