Quinolinium, 6-(dimethylamino)-2-(2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethenyl)-1-methyl-, chloride (1:1)
Basic information
- CAS
548-84-5- Standard SMILES
Cc1cc(/C=C/c2ccc3cc(N(C)C)ccc3[n+]2C)c(C)n1-c1ccccc1.[Cl-]- InChIKey
IKUGNXPCGVYRHO-UHFFFAOYSA-M- Molecular formula
- C26H28ClN3
- Average molar mass
- 418 g/mol
- Monoisotopic mass
- 417.1971756
Names & identifiers
- Preferred name
- Quinolinium, 6-(dimethylamino)-2-(2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)ethenyl)-1-methyl-, chloride (1:1)
- IUPAC
- 2-[(E)-2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-trimethylquinolin-1-ium-6-amine chloride
- English name
- Pyrvinium
- Molecular weight
- 0
Names & synonyms
Pyrvinium chloride548-84-5Cloruro de pirvinioChlorure de pyrviniumPirvinio cloruroPyrvinii chloridumMT7O310S39QUINOLINIUM, 6-(DIMETHYLAMINO)-2-(2-(2,5-DIMETHYL-1-PHENYL-1H-PYRROL-3-YL)ETHENYL)-1-METHYL-, CHLORIDE (1:1)DTXSID90970147pyrvinii embonaspyrvinium (base)pyrvinium embonicum
Show more names
RefChem:1097915P02CX01DTXCID301841943Pirvinio pamoatoPyrvinium chloride [INN]6-Dimethylamino-2'-(2-(2,5-dimethyl-1-phenyl-3-pyrrolyl)vinyl)-1-methylquinolinium chloride2-[(E)-2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-trimethylquinolin-1-ium-6-amine;chloridePyrviniumchlorid
Database identifiers
- CAS
548-84-5- PubChem CID
- 6433474
- ChEMBL
CHEMBL2105340- UNII
- MT7O310S39
Properties
Computed structural properties
- Topological polar surface area
- 12.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 552
Physicochemical properties
- Melting point
- 249 · 249-251 °C
- FDA UNII
- 7 O310S39 · MT7O310S39
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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