Bersacapavir
N-(3-cyano-4-fluorophenyl)-1-methyl-4-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]pyrrole-2-carboxamide
Molecular Identity
Bersacapavir
N-(3-cyano-4-fluorophenyl)-1-methyl-4-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]pyrrole-2-carboxamide
PubChem CID: 121294984
2D Structure
Properties
C16H14F4N4O3S
Molecular Formula
418.40
Molecular Weight
g/mol
418.0723
Exact Mass
Da
2.2
XLogP
Drug-like (Lipinski: < 5)
112
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
9
H-Bond Acceptors
730
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Bersacapavir1638266-40-6JNJ-6379JNJ-561363792456KW21661H-Pyrrole-2-carboxamide, N-(3-cyano-4-fluorophenyl)-1-methyl-4-((((1S)-2,2,2-trifluoro-1-methylethyl)amino)sulfonyl)-N-(3-Cyano-4-fluorophenyl)-1-methyl-4-(((2S)-1,1,1-trifluoro-2-propanyl)sulfamoyl)-1hpyrrole-2-carboxamideRefChem:119098UNII-2456KW2166Bersacapavir [INN]Bersacapavir [USAN]Bersacapavir [USAN:INN]WHO 11272N-(3-cyano-4-fluorophenyl)-1-methyl-4-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]pyrrole-2-carboxamide(S)-N-(3-Cyano-4-fluorophenyl)-1-methyl-4-(N-(1,1,1-trifluoropropan-2-yl)sulfamoyl)-1H-pyrrole-2-carboxamide
Data from PubChem (NCBI)
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