Basic information
- Standard SMILES
C1=C(c2c[nH]c3ccccc23)CCN(CCc2csc3ccccc23)C1- InChIKey
RXJDZAPGSNAPJI-UHFFFAOYSA-N- Molecular formula
- C23H22N2S
- Average molar mass
- 358.5 g/mol
Names & identifiers
- Preferred name
- 3-{1-[2-(1-benzothiophene-3-yl)ethyl]-1,2,3,6-tetrahydro-4-pyridinyl}-1H-indole
- IUPAC
- 3-[1-[2-(1-benzothiophen-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole
Names & synonyms
SCHEMBL5480768RXJDZAPGSNAPJI-UHFFFAOYSA-N3-{1-[2-(1-benzothiophene-3-yl)ethyl]-1,2,3,6-tetrahydro-4-pyridinyl}-1H-indole
Database identifiers
- PubChem CID
- 11233664
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 518
Related reactions
4 records
Compound notes
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