5-bromo-N-[4-(tert-butylsulfamoyl)phenyl]furan-2-carboxamide

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Basic information

CAS: 651298-81-6
Standard SMILES: CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1
InChIKey: QJAFGSWGCFILHT-UHFFFAOYSA-N
Molecular formula: C15H17BrN2O4S
Average molar mass: 401.3 g/mol

Names & identifiers

Preferred name: 5-bromo-N-[4-(tert-butylsulfamoyl)phenyl]furan-2-carboxamide
IUPAC: 5-bromo-N-[4-(tert-butylsulfamoyl)phenyl]furan-2-carboxamide
English name: 5-bromo-N-{4-[(tert-butylamino)sulfonyl]phenyl}-2-furamide
Molecular formula: C15H17BrN2O4S
Molecular weight: 401.27548

Names & synonyms

5-bromo-N-[4-(tert-butylsulfamoyl)phenyl]furan-2-carboxamide5-bromo-N-{4-[(tert-butylamino)sulfonyl]phenyl}-2-furamideHMS1594G03STL062820AKOS000496633651298-81-6AN-329/42174071SR-01000277498SR-01000277498-1

Database identifiers

CAS: 651298-81-6

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 96.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 23
Formal charge: 0
Complexity: 519

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