Nesbuvir
5-cyclopropyl-2-(4-fluorophenyl)-6-[2-hydroxyethyl(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamide
Molecular Identity
Nesbuvir
5-cyclopropyl-2-(4-fluorophenyl)-6-[2-hydroxyethyl(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamide
PubChem CID: 11561383
2D Structure
Properties
C22H23FN2O5S
Molecular Formula
446.50
Molecular Weight
g/mol
446.1312
Exact Mass
Da
2.7
XLogP
Drug-like (Lipinski: < 5)
108
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
747
Complexity
SMILES
Canonical SMILES
SMILES: CNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCO)S(=O)(=O)C)C4=CC=C(C=C4)FIsomeric SMILES
SMILES: CNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCO)S(=O)(=O)C)C4=CC=C(C=C4)FSynonyms(20)
Nesbuvir691852-58-1HCV-796HCV796HCV 796EYK815W3Z85-cyclopropyl-2-(4-fluorophenyl)-6-[2-hydroxyethyl(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamideDTXSID902192255-Cyclopropyl-2-(4-fluorophenyl)-6-((2-hydroxyethyl)(methylsulfonyl)amino)-N-methyl-1-benzofuran-3-carboxamide5-Cyclopropyl-2-(4-Fluorophenyl)-6-[(2-Hydroxyethyl)(Methylsulfonyl)amino]-N-Methyl-1-Benzofuran-3-Carboxamidenesbuvirum5-cyclopropyl-2-(4-fluorophenyl)-6-(2-hydroxyethyl(methylsulfonyl)amino)-N-methyl-1-benzofuran-3-carboxamideRefChem:165532DTXCID10141716Nesbuvir (USAN)
Data from PubChem (NCBI)
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