Products 112559-91-8

CAS 112559-91-8 appears in our catalog under these names: Hydroxy Itraconazole, >95% (HPLC), Hydroxy Itraconazole, 4-(4-(4-(4-((2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(3-hydroxybutan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one, 98%, 98%, Hydroxy Itraconazole, 99.80%, Hydroxy Itraconazole (Standard). Offered by: TRC, TargetMol, Biosynth, Chemat, MedChemExpress. Available pack sizes: 10mg, 1mg, 25mg, 2mg, 5mg, 50mg, 100mg, 250mg.

Hydroxy Itraconazole, >95% (HPLC)
TRC
  • size: 10mg, 1mg, 25mg
  • Variants: 3
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Hydroxy Itraconazole
TargetMol, Biosynth
  • size: 2mg, 5mg, 10mg, 1mg
  • Variants: 7
from 2676.93
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4-(4-(4-(4-((2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(3-hydroxybutan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one, 98%, 98%
Chemat
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 7
from 386.00
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Hydroxy Itraconazole, 99.80%
MedChemExpress
  • size: 50 mg, 5 mg, 25 mg, 10 mg
  • Variants: 4
from 3719.10
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Hydroxy Itraconazole (Standard)
MedChemExpress
  • size: Get quote
  • Variants: 1
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Structural formula: {0} (CAS {1})

4-[4-[4-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3-hydroxybutan-2-yl)-1,2,4-triazol-3-one (CAS 112559-91-8) is a chemical compound with the molecular formula C35H38Cl2N8O5 and a molecular weight of 721.6 g/mol. IUPAC name: 4-[4-[4-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3-hydroxybutan-2-yl)-1,2,4-triazol-3-one. InChIKey: ISJVOEOJQLKSJU-UHFFFAOYSA-N.

Identity
Molecular formulaC35H38Cl2N8O5
Molecular weight721.6 g/mol
IUPAC name4-[4-[4-[4-[[2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3-hydroxybutan-2-yl)-1,2,4-triazol-3-one
InChIKeyISJVOEOJQLKSJU-UHFFFAOYSA-N
SMILESCC(C(C)O)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OCC5COC(O5)(CN6C=NC=N6)C7=C(C=C(C=C7)Cl)Cl

Computed by PubChem (NCBI)

Synonyms: Hydroxy Itraconazole, Itraconazole 2-Hydroxy Metabolite, C35H38Cl2N8O5, Hydroxy Itra, Hydroxy Itraconazole (Mixture of Diastereomers), orb1679019, orb3141326, Hydroxy Itraconazole;R-63373, ISJVOEOJQLKSJU-UHFFFAOYSA-N
Related forms of this compound
4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(1,1,1,2,3,4,4,4-octadeuterio-3-hydroxybutan-2-yl)-1,2,4-triazol-3-one C35H38Cl2N8O5
4-[4-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3-hydroxybutan-2-yl)-1,2,4-triazol-3-one C35H38Cl2N8O5
4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(2,3,4,4,4-pentadeuterio-3-hydroxybutan-2-yl)-1,2,4-triazol-3-one C35H38Cl2N8O5