Basic information
- CAS
140865-88-9- Standard SMILES
CN1[C@@H]2CC[C@H]1CC(NC(=O)N1CC(C)(C)c3ccccc31)C2.Cl- InChIKey
KYQBGUPALRZQEE-XZPOUAKSSA-N- Molecular formula
- C19H28ClN3O
- Average molar mass
- 349.9 g/mol
- Monoisotopic mass
- 349.1920902
Names & identifiers
- Preferred name
- Ricasetron hydrochloride
- IUPAC
- 3,3-dimethyl-N-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2H-indole-1-carboxamide;hydrochloride
Names & synonyms
Ricasetron hydrochloride140865-88-9B8A73VO6UMBRL-46470ARicasetron HClBRL 46470AUNII-B8A73VO6UM3,3-dimethyl-N-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2H-indole-1-carboxamide;hydrochloride1H-Indole-1-carboxamide, 2,3-dihydro-3,3-dimethyl-N-((3-endo)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl)-, monohydrochloride
Database identifiers
- CAS
140865-88-9- PubChem CID
- 178563
- UNII
- B8A73VO6UM
Properties
Computed structural properties
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 463
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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