Posaconazole Impurity 51 CAS#: 357189-94-7

Posaconazole Impurity 51

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Product Name:

Posaconazole Impurity 51

Synonyms:

Posaconazole Impurity 51
4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]-1-[4-[1-[(2S,3S)-2-hydroxypentan-3-yl]-5-oxo-1,2,4-triazol-4-yl]phenyl]piperazin-2-one
Posaconazole 3-Oxo Impurity
Posaconazole Impurity 107
3-Oxo-posaconazole (3-?oxo-?1-?piperazinyl)
1-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)-4-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazin-2-one
4-(4-(((3R,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)-tetrahydrofuran-3-yl)methoxy)phenyl)-1-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1H-1,2,4-triazol-4(5H)-yl)phenyl)piperazin-2-one
4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methoxy)phenyl)-1-(4-(1-((2S,3S)-2-hydroxypentan-3-yl)-5-oxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)phenyl)piperazin-2-one

CAS:

357189-94-7

MF:

C37H40F2N8O5

MW:

714.7609064

Mol File:

357189-94-7.mol

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Boiling point:: 911.4±75.0 °C(Predicted)
Density: 1.40±0.1 g/cm3(Predicted)
pka: 14.72±0.20(Predicted)
InChIKey: ZZDLBPMUUVZXAY-NOJACZOXNA-N
SMILES: N1(C2=CC=C(N3C(=O)N([C@@H](CC)[C@@H](O)C)N=C3)C=C2)CCN(C2=CC=C(OC[C@H]3C[C@@](C4=CC=C(F)C=C4F)(CN4C=NC=N4)OC3)C=C2)CC1=O |&1:9,12,28,30,r|

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3-Oxo-posaconazole is an impurity of posaconazole (P689600) which is an orally active triazole antifungal.

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