Hydroxy Itraconazole D8

cas: 1217516-26-1 — see every product listed under this CAS number, including other names

Hydroxy Itraconazole D8 (CAS 1217516-26-1) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberRM-I222027
cas1217516-26-1
sizeon request
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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 (CAS 1217516-26-1) is a chemical compound with the molecular formula C35H38Cl2N8O5 and a molecular weight of 729.7 g/mol. IUPAC name: 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. InChIKey: ISJVOEOJQLKSJU-ARDUPOLYSA-N.

Identity
Molecular formulaC35H38Cl2N8O5
Molecular weight729.7 g/mol
IUPAC name4-[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
InChIKeyISJVOEOJQLKSJU-ARDUPOLYSA-N
SMILES[2H]C([2H])([2H])C([2H])(C([2H])(C([2H])([2H])[2H])O)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

Computed by PubChem (NCBI)

Synonyms: Hydroxy Itraconazole-d8, Hydroxy Itraconazole D8, (2R,4S)-Hydroxy Itraconazole-d8
Related forms of this compound
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-[[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

Also listed as

Hydroxy Itraconazole-d8 (Mixture of Diastereomers) Chemat Brand CAS 1217516-26-1
Hydroxy Itraconazole-d8 TRC CAS 1217516-26-1
(2R,4S)-Hydroxy Itraconazole-d8 MedChemExpress CAS 1217516-26-1