Basic information
- Standard SMILES
N#Cc1ccc(CCCN2CCCc3cc(NS(=O)(=O)c4ccccc4)ccc32)cc1- InChIKey
DUHNRCAPGLPFDJ-UHFFFAOYSA-N- Molecular formula
- C25H25N3O2S
- Average molar mass
- 431.6 g/mol
Names & identifiers
- Preferred name
- 1-[3-(4-Cyano-phenyl)propyl]-6-phenylsulphonamido-1,2,3,4-tetrahydro-quinoline
- IUPAC
- N-[1-[3-(4-cyanophenyl)propyl]-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide
Names & synonyms
SCHEMBL6983682DUHNRCAPGLPFDJ-UHFFFAOYSA-N1-[3-(4-cyano-phenyl)propyl]-6-phenylsulphonamido-1,2,3,4-tetrahydro-quinoline
Database identifiers
- PubChem CID
- 18367170
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 81.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 711
Related reactions
2 records
Compound notes
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