Products 142128-59-4

CAS 142128-59-4 appears in our catalog under these names: (+)-Ketoconazole, >95% (HPLC), (+)-Ketoconazole, 99.79%. Offered by: TRC, MedChemExpress. Available pack sizes: 250mg, 10mM/1mL, 10 mg, 5 mg, 100 mg, 50 mg, 25 mg.

(+)-Ketoconazole, >95% (HPLC)
TRC
  • size: 250mg
  • Variants: 1
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(+)-Ketoconazole, 99.79%
MedChemExpress
  • size: 10mM/1mL, 10 mg, 5 mg, 100 mg
  • Variants: 6
from 384.71
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Structural formula: {0} (CAS {1})

(2R,4S)-ketoconazole is a cis-1-acetyl-4-(4-{[2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazine which dioxolane moiety has (2R,4S)-configuration. It is an enantiomer of a (2S,4R)-ketoconazole.

Source: ChEBI

Identity
Molecular formulaC26H28Cl2N4O4
Molecular weight531.4 g/mol
IUPAC name1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone
InChIKeyXMAYWYJOQHXEEK-OZXSUGGESA-N
SMILESCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC[C@H]3CO[C@](O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl

Computed by PubChem (NCBI)

Synonyms: (2R,4S)-ketoconazole, (+)-Ketoconazole, C26H28Cl2N4O4, KTZ, (+)-(2R,4S)-Ketoconazole, Ketoconazole RS, Ketoconazole CRS, Ketoconazole (k), Prestwick_744, Tocris-1103
Related forms of this compound
1-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4
1-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4
2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4
1-[4-[4-[[(2R,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4
1-[2,2,3,3,5,5,6,6-octadeuterio-4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4
1-[3,3,5,5-tetradeuterio-4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4
1-[4-[4-[[(2R,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4
1-[4-[4-[[(2S,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone C26H28Cl2N4O4