1-Butanol, 1-(N-(2-imidazolin-2-yl)-N-(2-phenyl-3-indolylmethyl)amino)-, hydriodide
Basic information
- CAS
77587-78-1- Standard SMILES
CCCC(O)[NH+](Cc1c(-c2ccccc2)[nH]c2ccccc12)C1=NCCN1.[I-]- InChIKey
RDLSOVZCNDYWKO-UHFFFAOYSA-N- Molecular formula
- C22H27IN4O
- Average molar mass
- 490.4 g/mol
- Monoisotopic mass
- 490.12296
Names & identifiers
- Preferred name
- 1-Butanol, 1-(N-(2-imidazolin-2-yl)-N-(2-phenyl-3-indolylmethyl)amino)-, hydriodide
- IUPAC
- 4,5-dihydro-1H-imidazol-2-yl-(1-hydroxybutyl)-[(2-phenyl-1H-indol-3-yl)methyl]azanium iodide
Names & synonyms
1-(N-(2-Imidazolin-2-yl)-N-(2-phenyl-3-indolylmethyl)amino)-1-butanol hydriodide1-Butanol, 1-(N-(2-imidazolin-2-yl)-N-(2-phenyl-3-indolylmethyl)amino)-, hydriodide77587-78-1RefChem:228792
Database identifiers
- CAS
77587-78-1- PubChem CID
- 53688
Properties
Computed structural properties
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 505
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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