3-Fluoro-4-(3-methyl-2,5-dioxo-1-pyrrolidinyl)benzenesulfonamide

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Basic information

CAS: 30279-50-6
Standard SMILES: CC1CC(=O)N(c2ccc(S(N)(=O)=O)cc2F)C1=O
InChIKey: KCXGBZQYLAGPSG-UHFFFAOYSA-N
Molecular formula: C11H11FN2O4S
Average molar mass: 286.28 g/mol
Monoisotopic mass: 286.04235617

Names & identifiers

Preferred name: 3-Fluoro-4-(3-methyl-2,5-dioxo-1-pyrrolidinyl)benzenesulfonamide
IUPAC: 3-fluoro-4-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzenesulfonamide

Names & synonyms

30279-50-6RefChem:10678303-Fluoro-4-(3-methyl-2,5-dioxo-1-pyrrolidinyl)benzenesulfonamide3-fluoro-4-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzenesulfonamide4-(2,5-Dioxo-3-methyl-1-pyrrolidinyl)-3-fluorobenzenesulfonamidePB 390BRN 1548247Benzenesulfonamide, 4-(2,5-dioxo-3-methyl-1-pyrrolidinyl)-3-fluoro-DTXSID109526473-Fluoro-4-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzene-1-sulfonamide

Database identifiers

CAS: 30279-50-6
PubChem CID: 207606
DTXSID: DTXSID10952647

Properties

Computed structural properties

XLogP: -0.1
Topological polar surface area: 106 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 2
Heavy atoms: 19
Formal charge: 0
Complexity: 501

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Compound notes

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