2(2-(1-ET-1H-Quinolin-2-ylidene)ethylidene)benzo(4,5)imidazo(2,1-B)thiazol-3-one
Basic information
- CAS
298685-25-3- Standard SMILES
CCN1/C(=C/C=c2/sc3nc4ccccc4n3c2=O)C=Cc2ccccc21- InChIKey
VADXSPLJQYSMHQ-FNBOUAQFSA-N- Molecular formula
- C22H17N3OS
- Average molar mass
- 371.5 g/mol
- Monoisotopic mass
- 371.10923335
Names & identifiers
- Preferred name
- 2(2-(1-ET-1H-Quinolin-2-ylidene)ethylidene)benzo(4,5)imidazo(2,1-B)thiazol-3-one
- IUPAC
- (2E)-2-[(2E)-2-(1-ethylquinolin-2-ylidene)ethylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Names & synonyms
HMS639B19AKOS001603694ST047648AG-205/13109230SR-01000414412SR-01000414412-12(2-(1-ET-1H-QUINOLIN-2-YLIDENE)ETHYLIDENE)BENZO(4,5)IMIDAZO(2,1-B)THIAZOL-3-ONE2-[2-(1-ethyl-2-hydroquinolylidene)ethylidene]-1,3-thiazolidino[3,2-a]benzimid azol-3-one2-[2-(1-ethyl-2(1H)-quinolinylidene)ethylidene][1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Database identifiers
- CAS
298685-25-3- PubChem CID
- 5290656
- EC Number
- 163-544-9
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 700
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