Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)NC2CCCCNC2)cc1- InChIKey
YWYQIOHUFALRRW-UHFFFAOYSA-N- Molecular formula
- C13H20N2O2S
- Average molar mass
- 268.38 g/mol
Names & identifiers
- Preferred name
- N-(Azepan-3-yl)-4-methylbenzenesulfonamide
- IUPAC
- N-(azepan-3-yl)-4-methylbenzenesulfonamide
Names & synonyms
N-(Azepan-3-yl)-4-methylbenzenesulfonamide485820-33-5SCHEMBL4668508YWYQIOHUFALRRW-UHFFFAOYSA-NAKOS013319784DB-352407
Database identifiers
- PubChem CID
- 22508595
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 342
Related reactions
6 records
Compound notes
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