Basic information
- Standard SMILES
CCCCN(CC(=O)OCC)S(=O)(=O)c1ccc(N2CCC(=O)CC2)cc1- InChIKey
TWAXCAWYRIYHNJ-UHFFFAOYSA-N- Molecular formula
- C19H28N2O5S
- Average molar mass
- 396.5 g/mol
Names & identifiers
- Preferred name
- {Butyl-[4-(4-oxo-piperidin-1-yl)-benzenesulfonyl]-amino}-acetic acid ethyl ester
- IUPAC
- ethyl 2-[butyl-[4-(4-oxopiperidin-1-yl)phenyl]sulfonylamino]acetate
Names & synonyms
SCHEMBL6799938TWAXCAWYRIYHNJ-UHFFFAOYSA-N{Butyl-[4-(4-oxo-piperidin-1-yl)-benzenesulfonyl]-amino}-acetic acid ethyl ester
Database identifiers
- PubChem CID
- 69899530
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 584
Related reactions
5 records
Compound notes
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