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Basic information
- Standard SMILES
CC(C)NS(=O)(=O)c1ccc(-c2ccc(NC(=O)C3CN4CCC3CC4)cc2)cc1- InChIKey
QTVVDFIULNKWOM-UHFFFAOYSA-N- Molecular formula
- C23H29N3O3S
- Average molar mass
- 427.6 g/mol
- Monoisotopic mass
- 427.19296297
Names & identifiers
- Preferred name
- N-[4-[4-(propan-2-ylsulfamoyl)phenyl]phenyl]-1-azabicyclo[2.2.2]octane-3-carboxamide
- IUPAC
- N-[4-[4-(propan-2-ylsulfamoyl)phenyl]phenyl]-1-azabicyclo[2.2.2]octane-3-carboxamide
Database identifiers
- PubChem CID
- 72822016
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 681
Related reactions
1 records
Compound notes
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