Batabulin Sodium
sodium (3-fluoro-4-methoxyphenyl)-(2,3,4,5,6-pentafluorophenyl)sulfonylazanide
Molecular Identity
Batabulin Sodium
sodium (3-fluoro-4-methoxyphenyl)-(2,3,4,5,6-pentafluorophenyl)sulfonylazanide
PubChem CID: 23669770
2D Structure
Properties
C13H6F6NNaO3S
Molecular Formula
393.24
Molecular Weight
g/mol
392.9870
Exact Mass
Da
52.8
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
10
H-Bond Acceptors
522
Complexity
SMILES
Canonical SMILES
SMILES: COC1=C(C=C(C=C1)[N-]S(=O)(=O)C2=C(C(=C(C(=C2F)F)F)F)F)F.[Na+]Isomeric SMILES
SMILES: COC1=C(C=C(C=C1)[N-]S(=O)(=O)C2=C(C(=C(C(=C2F)F)F)F)F)F.[Na+]Synonyms(20)
Batabulin sodium195533-98-3T138067-sodiumT138067 sodiumBatabulin Sodium [USAN]T 138067 sodiumT-138067 SodiumUNII-G04B77F772Batabulin sodium (USAN)G04B77F772DTXSID30173231BATABULIN SODIUM [WHO-DD]2,3,4,5,6-Pentafluoro-N-(3-fluoro-4-methoxyphenyl)benzenesulfonamide sodium salt2-Fluoro-1-methoxy-4-((pentafluorophenyl)sulfonamido)benzene sodium salt2-Fluoro-1-methoxy-4-pentafluorophenylsulfonamidobenzene, sodium salt
Data from PubChem (NCBI)
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