Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-methyl-3-phenyl-, dihydrochloride
Basic information
- CAS
57647-53-7- Standard SMILES
Cc1ccc2c(c1)c(-c1ccccc1)cn2N(CC[NH+](C)C)CC[NH+](C)C.[Cl-].[Cl-]- InChIKey
JLNCMKDXAASZEZ-UHFFFAOYSA-N- Molecular formula
- C23H34Cl2N4
- Average molar mass
- 437.4 g/mol
- Monoisotopic mass
- 436.2160525
Names & identifiers
- Preferred name
- Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-methyl-3-phenyl-, dihydrochloride
- IUPAC
- 2-[2-(dimethylazaniumyl)ethyl-(5-methyl-3-phenylindol-1-yl)amino]ethyl-dimethylazanium dichloride
Names & synonyms
1-(Bis(2-(dimethylamino)ethyl)amino)-5-methyl-3-phenylindole dihydrochlorideINDOLE, 1-(BIS(2-(DIMETHYLAMINO)ETHYL)AMINO)-5-METHYL-3-PHENYL-, DIHYDROCHLORIDE57647-53-7RefChem:349147
Database identifiers
- CAS
57647-53-7- PubChem CID
- 42525
Properties
Computed structural properties
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 420
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