Basic information
- Standard SMILES
CON1CCC(Sc2cn(C)c3ccc(Br)cc23)CC1- InChIKey
UFZSQQKCHHDSRS-UHFFFAOYSA-N- Molecular formula
- C15H19BrN2OS
- Average molar mass
- 355.3 g/mol
Names & identifiers
- Preferred name
- 5-bromo-3-[(1-methoxypiperidin-4-yl)thio]-1-methyl-1H-indole
- IUPAC
- 5-bromo-3-(1-methoxypiperidin-4-yl)sulfanyl-1-methylindole
Names & synonyms
SCHEMBL9171321UFZSQQKCHHDSRS-UHFFFAOYSA-N5-bromo-3-[(1-methoxypiperidin-4-yl)thio]-1-methyl-1H-indole
Database identifiers
- PubChem CID
- 19936655
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 42.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 325
Related reactions
2 records
Compound notes
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