Basic information
- Standard SMILES
Cn1c(SCC(=O)N2CCCc3ccccc32)nc2ccccc21- InChIKey
UQSBNSHVXBLCTC-UHFFFAOYSA-N- Molecular formula
- C19H19N3OS
- Average molar mass
- 337.4 g/mol
- Monoisotopic mass
- 337.12488341
Names & identifiers
- Preferred name
- 1-(3,4-Dihydro-2H-quinolin-1-yl)-2-(1-methyl-1H-benzoimidazol-2-ylsulfanyl)ethanone
- IUPAC
- 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylethanone
Names & synonyms
SCHEMBL3096645UQSBNSHVXBLCTC-UHFFFAOYSA-NAKOS033419282Z154789541-(3,4-Dihydro-2H-quinolin-1-yl)-2-(1-methyl-1H-benzoimidazol-2-ylsulfanyl)ethanone
Database identifiers
- PubChem CID
- 40688693
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 460
Related reactions
3 records
Compound notes
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