Posaconazole Impurity 1

cas: 1388148-29-5 — see every product listed under this CAS number, including other names

Posaconazole Impurity 1 (CAS 1388148-29-5) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULP388
cas1388148-29-5
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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categoryChemicals
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4-[4-[3-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]imidazolidin-1-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one (CAS 1388148-29-5) is a chemical compound with the molecular formula C36H40F2N8O4 and a molecular weight of 686.7 g/mol. IUPAC name: 4-[4-[3-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]imidazolidin-1-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one. InChIKey: GCEOWVCWJMMIAY-YUYQYMTJSA-N.

Identity
Molecular formulaC36H40F2N8O4
Molecular weight686.7 g/mol
IUPAC name4-[4-[3-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]imidazolidin-1-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one
InChIKeyGCEOWVCWJMMIAY-YUYQYMTJSA-N
SMILESCC[C@@H]([C@H](C)O)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(C3)C4=CC=C(C=C4)OC[C@H]5C[C@](OC5)(CN6C=NC=N6)C7=C(C=C(C=C7)F)F

Computed by PubChem (NCBI)

Synonyms: Posaconazole Impurity X, Posaconazole Imidazolidine Impurity, PosaconazoleImidazolidineImpurity
Isomers (same molecular formula)
4-[4-[7-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]-1,2,3,5-tetrahydro-1,4-benzodiazepin-4-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one C36H40F2N8O4

Also listed as

Posaconazole Impurity X Chemat Brand CAS 1388148-29-5
Posaconazole Impurity 41 Hubei YoungXin CAS 1388148-29-5
Posaconazole Imidazolidine Impurity TRC CAS 1388148-29-5