Pyridinium, 4-(2-indol-3-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide
Basic information
- CAS
21199-25-7- Standard SMILES
C[N+](C)(C)CCC[n+]1ccc(CCc2c[nH]c3ccccc23)cc1.[Br-].[Br-]- InChIKey
MWLHSMMCWPOORG-UHFFFAOYSA-L- Molecular formula
- C21H29Br2N3
- Average molar mass
- 483.3 g/mol
- Monoisotopic mass
- 481.07282
Names & identifiers
- Preferred name
- Pyridinium, 4-(2-indol-3-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromide
- IUPAC
- 3-[4-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-1-yl]propyl-trimethylazanium dibromide
Names & synonyms
21199-25-74-(2-Indol-3-ylethyl)-1-(3-(trimethylammonio)propyl)pyridinium dibromidePyridinium, 4-(2-indol-3-ylethyl)-1-(3-(trimethylammonio)propyl)-, dibromideRefChem:3772314-(2-(1H-Indol-3-yl)ethyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromideDTXSID309435324-[2-(1H-Indol-3-yl)ethyl]-1-[3-(trimethylazaniumyl)propyl]pyridin-1-ium dibromide
Database identifiers
- CAS
21199-25-7- PubChem CID
- 210241
- DTXSID
DTXSID30943532
Properties
Computed structural properties
- Topological polar surface area
- 19.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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