Name: Sofosbuvir impurity B
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT212670454
Cas No:
常用名:Sofosbuvir impurity B
IUPAC:propan-2-yl (2S)-2-{[(S)-{[(2R,3R,4R,5S)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy}(phenoxy)phosphoryl]amino}propanoate
IUPAC:propan-2-yl (2S)-2-{[(S)-{[(2R,3R,4R,5S)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy}(phenoxy)phosphoryl]amino}propanoate
InChI key:TTZHDVOVKQGIBA-OZMUOUHISA-N

分子式:C22H29FN3O9P
分子量:529.458
氢键供体数 (HBD):3
氢键受体数 (HBA):6
LogP:1.2836041
SMILES:CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)[C@@H]1O)Oc1ccccc1
SMILES:CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)[C@@H]1O)Oc1ccccc1

Sofosbuvir impurity B is the less active impurity of Sofosbuvir. Sofosbuvir is an active HCV RNA replication inhibitor in the HCV replicon assay, with potent anti-hepatitis C virus (HCV) activity.

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