Indole, 1-(bis(3-(dimethylamino)propyl)amino)-5-chloro-3-phenyl-,dihydrochloride
Basic information
- CAS
57647-50-4- Standard SMILES
C[NH+](C)CCCN(CCC[NH+](C)C)n1cc(-c2ccccc2)c2cc(Cl)ccc21.[Cl-].[Cl-]- InChIKey
CJBKKAHGVLBKOC-UHFFFAOYSA-N- Molecular formula
- C24H35Cl3N4
- Average molar mass
- 485.9 g/mol
- Monoisotopic mass
- 484.19273
Names & identifiers
- Preferred name
- Indole, 1-(bis(3-(dimethylamino)propyl)amino)-5-chloro-3-phenyl-,dihydrochloride
- IUPAC
- 3-[(5-chloro-3-phenylindol-1-yl)-[3-(dimethylazaniumyl)propyl]amino]propyl-dimethylazanium dichloride
Names & synonyms
1-(Bis(3-(dimethylamino)propyl)amino)-5-chloro-3-phenylindole dihydrochloride57647-50-4INDOLE, 1-(BIS(3-(DIMETHYLAMINO)PROPYL)AMINO)-5-CHLORO-3-PHENYL-,DIHYDROCHLORIDERefChem:349150
Database identifiers
- CAS
57647-50-4- PubChem CID
- 42519
Properties
Computed structural properties
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 452
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