3-Ethyl-2-(3-(3-ethylthiazolo(4,5-b)quinolin-2(3H)-ylidene)-1-propenyl)thiazolo(4,5-b)quinolinium bromide
Basic information
- CAS
52762-72-8- Standard SMILES
CCN1/C(=C\C=C\c2sc3cc4ccccc4nc3[n+]2CC)Sc2cc3ccccc3nc21.[Br-]- InChIKey
ZESFQPAXLPWUQL-UHFFFAOYSA-M- Molecular formula
- C27H23BrN4S2
- Average molar mass
- 547.5 g/mol
- Monoisotopic mass
- 546.05475
Names & identifiers
- Preferred name
- 3-Ethyl-2-(3-(3-ethylthiazolo(4,5-b)quinolin-2(3H)-ylidene)-1-propenyl)thiazolo(4,5-b)quinolinium bromide
- IUPAC
- (2E)-3-ethyl-2-[(E)-3-(3-ethyl-[1,3]thiazolo[4,5-b]quinolin-3-ium-2-yl)prop-2-enylidene]-[1,3]thiazolo[4,5-b]quinoline bromide
Names & synonyms
52762-72-83-Ethyl-2-(3-(3-ethylthiazolo(4,5-b)quinolin-2(3H)-ylidene)-1-propenyl)thiazolo(4,5-b)quinolinium bromideThiazolo(4,5-b)quinolinium, 3-ethyl-2-(3-(3-ethylthiazolo(4,5-b)quinolin-2(3H)-ylidene)-1-propenyl)-, bromide
Database identifiers
- CAS
52762-72-8- PubChem CID
- 6441682
Properties
Computed structural properties
- Topological polar surface area
- 86.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 696
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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