Basic information
- Standard SMILES
CCC(=O)C(CCCCCCOc1ccc(S(N)(=O)=O)cc1)C(=O)CC- InChIKey
JDDKLWIAXNZHSA-UHFFFAOYSA-N- Molecular formula
- C19H29NO5S
- Average molar mass
- 383.5 g/mol
Names & identifiers
- Preferred name
- 4-(8-Oxo-7-propanoyl-decoxy)benzenesulfonamide
- IUPAC
- 4-(8-oxo-7-propanoyldecoxy)benzenesulfonamide
Names & synonyms
CHEMBL3248940SCHEMBL11349238JDDKLWIAXNZHSA-UHFFFAOYSA-N4-(8-oxo-7-propanoyl-decoxy)benzenesulfonamide4-[6-(4-aminosulfonylphenoxy)hexyl]-3,5-heptanedioneBenzenesulfonamide, 4-[[8-oxo-7-(1-oxopropyl)decyl]oxy]-
Database identifiers
- PubChem CID
- 514077
- ChEMBL
CHEMBL3248940
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 517
Related reactions
2 records
Compound notes
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