Basic information
- Standard SMILES
OC1CCN(CCCOCCc2ccc3sccc3c2)C1- InChIKey
QCJAWVGLGSMDJU-UHFFFAOYSA-N- Molecular formula
- C17H23NO2S
- Average molar mass
- 305.4 g/mol
Names & identifiers
- Preferred name
- 1-(3-(2-(1-Benzothiophene-5-yl)ethoxy)propyl)-3-pyrrolidinol
- IUPAC
- 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]pyrrolidin-3-ol
Names & synonyms
SCHEMBL48249QCJAWVGLGSMDJU-UHFFFAOYSA-N1-(3-(2-(1-benzothiophene-5-yl)ethoxy)propyl)-3-pyrrolidinol1-{3-[2-(1-benzothiophen-5-yl)ethoxy]propyl}-3-pyrrolidinol
Database identifiers
- PubChem CID
- 21990037
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 315
Related reactions
7 records
Linked notes
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