Isopropyl Itraconazole

For research use only. Not for therapeutic Use.

  • CAT Number: R013193
  • CAS Number: 89848-49-7
  • Molecular Formula: C₃₄H₃₆Cl₂N₈O₄
  • Molecular Weight: 691.61
  • Purity: ≥95%
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Isopropyl Itraconazole(Cat No.: R013193) is a derivative of the antifungal drug itraconazole, used in pharmaceutical research. It is important for studying the pharmacokinetics, pharmacodynamics, and metabolic pathways of itraconazole and its analogs. This compound aids in understanding the drug’s mechanism of action and optimizing therapeutic efficacy. Researchers rely on Isopropyl Itraconazole for precise and reliable results in advanced drug development and antifungal studies, contributing significantly to advancements in treating fungal infections.


Catalog Number R013193
CAS Number 89848-49-7
Synonyms

cis-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-(1-methylethyl)-3H-1,2,4-triazol-3-one;

Molecular Formula C₃₄H₃₆Cl₂N₈O₄
Purity ≥95%
Storage -20°C
IUPAC Name 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-propan-2-yl-1,2,4-triazol-3-one
InChI 1S/C34H36Cl2N8O4/c1-24(2)44-33(45)43(23-39-44)28-6-4-26(5-7-28)40-13-15-41(16-14-40)27-8-10-29(11-9-27)46-18-30-19-47-34(48-30,20-42-22-37-21-38-42)31-12-3-25(35)17-32(31)36/h3-12,17,21-24,30H,13-16,18-20H2,1-2H3/t30-,34-/m1/s1
InChIKey YPJNBOZLRNFTJN-KAODMTDESA-N
SMILES CC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC[C@@H]5CO[C@@](O5)(CN6C=NC=N6)C7=C(C=C(C=C7)Cl)Cl

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