Basic information
- Standard SMILES
Cc1ccc2[nH]c(C)c(SC3CCN(Cc4ccccc4)CC3)c2c1.Cl- InChIKey
FAFHLIOKWNLAFS-UHFFFAOYSA-N- Molecular formula
- C22H27ClN2S
- Average molar mass
- 387 g/mol
Names & identifiers
- Preferred name
- 2,5-Dimethyl-3-[[1-(phenylmethyl)piperidin-4-yl]thio]-1H-indole hydrochloride
- IUPAC
- 3-(1-benzylpiperidin-4-yl)sulfanyl-2,5-dimethyl-1H-indole;hydrochloride
Names & synonyms
SCHEMBL9174864FAFHLIOKWNLAFS-UHFFFAOYSA-N2,5-Dimethyl-3-[[1-(phenylmethyl)piperidin-4-yl]thio]-1H-indole hydrochloride
Database identifiers
- PubChem CID
- 19936613
Properties
Computed structural properties
- Topological polar surface area
- 44.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 414
Related reactions
2 records
Compound notes
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