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Chemical structure of Sofosbuvir impurity J

GC32350

Sofosbuvir impurity J

Also known as propan-2-yl (2S)-2-[[[(2R,3R,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

Sofosbuvir impurity J, an diastereoisomer of Sofosbuvir, is the impurity of Sofosbuvir

ChemicalCAS1334513-10-8MW528.47FormulaC22H30FN4O8P
CAS number
1334513-10-8
Molecular weight
528.47
Formula
C22H30FN4O8P
Solubility
Soluble in DMSO
InChIKey
JMTNHBQFZOWQKE-IQWMDFIBSA-N
Catalogue number
GC32350
Brand
GLPBIO
Computed properties PubChem CID 56649065 · XLogP 0.7 · TPSA 162 Ų · H-bond donors 3
XLogP
0.7
TPSA
162 Ų
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
11
Heavy atoms
36

SMILES C[C@@H](C(=O)OC(C)C)N[P@](=O)(OC[C@@H]1[C@H]([C@@]([C@@H](O1)N2C=CC(=NC2=O)N)(C)F)O)OC3=CC=CC=C3

Computed descriptors from PubChem (CID 56649065), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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