Posaconazole-d4, 99.9%

cas: 1133712-26-1 — see every product listed under this CAS number, including other names

Posaconazole-d4, 99.9% (CAS 1133712-26-1) is a chemical reagent available from Chemat. Available pack sizes: 1 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-17373S1-1 mg
cas1133712-26-1
size1 mg
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Available pack sizes

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MedChemExpress 1 mg 1801.13 Pln

properties

delivery time over 3 weeks
purity99.9%
Structural formula: {0} (CAS {1})

2-[(2S,3S)-2-hydroxypentan-3-yl]-4-[2,3,5,6-tetradeuterio-4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-1,2,4-triazol-3-one (CAS 1133712-26-1) is a chemical compound with the molecular formula C37H42F2N8O4 and a molecular weight of 704.8 g/mol. IUPAC name: 2-[(2S,3S)-2-hydroxypentan-3-yl]-4-[2,3,5,6-tetradeuterio-4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-1,2,4-triazol-3-one. InChIKey: RAGOYPUPXAKGKH-YWOVKAAPSA-N.

Identity
Molecular formulaC37H42F2N8O4
Molecular weight704.8 g/mol
IUPAC name2-[(2S,3S)-2-hydroxypentan-3-yl]-4-[2,3,5,6-tetradeuterio-4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-1,2,4-triazol-3-one
InChIKeyRAGOYPUPXAKGKH-YWOVKAAPSA-N
SMILES[2H]C1=C(C(=C(C(=C1N2CCN(CC2)C3=CC=C(C=C3)OC[C@H]4C[C@](OC4)(CN5C=NC=N5)C6=C(C=C(C=C6)F)F)[2H])[2H])N7C=NN(C7=O)[C@@H](CC)[C@H](C)O)[2H]

Computed by PubChem (NCBI)

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