Disprocynium 24
Basic information
- CAS
149578-82-5- Standard SMILES
CC(C)N1/C(=C/c2cc[n+](C(C)C)c3ccccc23)C=Cc2ccccc21- InChIKey
TYFOKKOWQOKKCH-UHFFFAOYSA-N- Molecular formula
- C25H27N2+
- Average molar mass
- 355.5 g/mol
- Monoisotopic mass
- 355.21742387
Overview
a cyanine-type inhibitor of extraneuronal monoamine transport
Names & identifiers
- Preferred name
- Disprocynium 24
- IUPAC
- (2E)-1-propan-2-yl-2-[(1-propan-2-ylquinolin-1-ium-4-yl)methylidene]quinoline
- English name
- disprocynium 24
- Molecular formula
- C25H27N2+
- Molecular weight
- 355.5
Names & synonyms
Disprocynium 241,1'-Diisopropyl-2,4'-cyanineDisprocynium24149578-82-5DTXSID70164340RefChem:135117DTXCID10868311-(1-Methylethyl)-2-((1-(1-methylethyl)-4(1H)-quinolinylidene)methyl)quinoliniumQ270770801-(Propan-2-yl)-4-{(E)-[1-(propan-2-yl)quinolin-2(1H)-ylidene]methyl}quinolin-1-iumQuinolinium, 1-(1-methylethyl)-2-((1-(1-methylethyl)-4(1H)-quinolinylidene)methyl)-
Database identifiers
- CAS
149578-82-5- PubChem CID
- 5487529
- DTXSID
DTXSID70164340- ChEMBL
CHEMBL339858- Nikkaji
- J568.573G、J569.327F
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 7.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 1
- Complexity
- 561
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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