Basic information
- Standard SMILES
c1ccc2c(CCCCN3CCc4c(sc5ccccc45)C3)c[nH]c2c1- InChIKey
IPFODYBJFQWQJB-UHFFFAOYSA-N- Molecular formula
- C23H24N2S
- Average molar mass
- 360.5 g/mol
- Monoisotopic mass
- 360.16601995
Names & identifiers
- Preferred name
- 2-[4-(3-Indolyl)butyl]-1,2,3,4-tetrahydrobenzothieno[2,3-c]pyridine
- IUPAC
- 2-[4-(1H-indol-3-yl)butyl]-3,4-dihydro-1H-[1]benzothiolo[2,3-c]pyridine
Names & synonyms
SCHEMBL10567582IPFODYBJFQWQJB-UHFFFAOYSA-N2-[4-(3-indolyl)butyl]-1,2,3,4-tetrahydrobenzothieno[2,3-c]pyridine
Database identifiers
- PubChem CID
- 13747486
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 469
Related reactions
3 records
Compound notes
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