Basic information
- Standard SMILES
CCS(=O)(=O)NC1CCCc2c(Br)cncc21- InChIKey
LVQOQLARLWRIDJ-UHFFFAOYSA-N- Molecular formula
- C11H15BrN2O2S
- Average molar mass
- 319.22 g/mol
Names & identifiers
- Preferred name
- N-(4-Bromo-5,6,7,8-tetrahydro-8-isoquinolinyl)ethanesulfonamide
- IUPAC
- N-(4-bromo-5,6,7,8-tetrahydroisoquinolin-8-yl)ethanesulfonamide
Names & synonyms
SCHEMBL14803686LVQOQLARLWRIDJ-UHFFFAOYSA-N1428652-01-0DB-403322N-(4-Bromo-5,6,7,8-tetrahydro-8-isoquinolinyl)ethanesulfonamide(rac)-Ethanesulfonic acid (4-bromo-5,6,7,8-tetrahydro-isoquinolin-8-yl)-amide
Database identifiers
- PubChem CID
- 89458481
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 355
Related reactions
4 records
Compound notes
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