Faldaprevir sodium
sodium trans-(1R,2S)-1-[[(2S,4R)-4-[8-bromo-7-methoxy-2-[2-(2-methylpropanoylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-1-[(2S)-2-(cyclopentyloxycarbonylamino)-3,3-dimethylbutanoyl]pyrrolidine-2-carbonyl]amino]-2-ethenylcyclopropane-1-carboxylate
Molecular Identity
Faldaprevir sodium
sodium trans-(1R,2S)-1-[[(2S,4R)-4-[8-bromo-7-methoxy-2-[2-(2-methylpropanoylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-1-[(2S)-2-(cyclopentyloxycarbonylamino)-3,3-dimethylbutanoyl]pyrrolidine-2-carbonyl]amino]-2-ethenylcyclopropane-1-carboxylate
PubChem CID: 56594927
2D Structure
Properties
C40H48BrN6NaO9S
Molecular Formula
891.80
Molecular Weight
g/mol
890.2285
Exact Mass
Da
229
TPSA
May have limited oral absorption
3
H-Bond Donors
12
H-Bond Acceptors
1540
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(19)
Faldaprevir sodiumFaldaprevir, sodium saltBI-201335 sodium saltBI-201335 Na saltBI-201335NaFaldaprevir sodium [USAN]BI 201335 NA1215856-44-2UNII-1494Q15E7Z1494Q15E7ZBI-201335 NABI-201335-NAorb1738265CHEMBL3544915Faldaprevir sodium (JAN/USAN)
Data from PubChem (NCBI)
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