Basic information
- Standard SMILES
CC(=O)N1c2ccc(C#C[Si](C)(C)C)cc2[C@H](Nc2ccc(C#N)cn2)C[C@@H]1C- InChIKey
GIPZSIVXHAGELR-HRAATJIYSA-N- Molecular formula
- C23H26N4OSi
- Average molar mass
- 402.6 g/mol
- Monoisotopic mass
- 402.187588
Names & identifiers
- Preferred name
- 6-(((2S,4R)-1-Acetyl-2-methyl-6-((trimethylsilyl)ethynyl)-1,2,3,4-tetrahydroquinolin-4-yl)amino)nicotinonitrile
- IUPAC
- 6-[[(2S,4R)-1-acetyl-2-methyl-6-(2-trimethylsilylethynyl)-3,4-dihydro-2H-quinolin-4-yl]amino]pyridine-3-carbonitrile
Names & synonyms
SCHEMBL13728008GIPZSIVXHAGELR-HRAATJIYSA-N6-(((2S,4R)-1-Acetyl-2-methyl-6-((trimethylsilyl)ethynyl)-1,2,3,4-tetrahydroquinolin-4-yl)amino)nicotinonitrile
Database identifiers
- PubChem CID
- 70978173
Properties
Computed structural properties
- Topological polar surface area
- 69 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 723
Related reactions
2 records
Compound notes
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