2-(2-Furoylmethylene)-3-ethyl-5-methylbenzothiazoline
Basic information
- CAS
68239-18-9- Standard SMILES
CCN1/C(=C/C(=O)c2ccco2)Sc2ccc(C)cc21- InChIKey
CHWBZQVEEZKJSL-YBEGLDIGSA-N- Molecular formula
- C16H15NO2S
- Average molar mass
- 285.4 g/mol
- Monoisotopic mass
- 285.08234989
Names & identifiers
- Preferred name
- 2-(2-Furoylmethylene)-3-ethyl-5-methylbenzothiazoline
- IUPAC
- (2Z)-2-(3-ethyl-5-methyl-1,3-benzothiazol-2-ylidene)-1-(furan-2-yl)ethanone
Names & synonyms
Ethanone, 2-(3-ethyl-5-methyl-2(3H)-benzothiazolylidene)-1-(2-furanyl)-68239-18-92-(2-Furoylmethylene)-3-ethyl-5-methylbenzothiazolineCHWBZQVEEZKJSL-YBEGLDIGSA-N
Database identifiers
- CAS
68239-18-9- PubChem CID
- 6437511
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 58.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 409
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationEthanone, 2-(3-ethyl-5-methyl-2(3H)-benzothiazolylidene)-1-(2-furanyl)-: INACTIVE
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Compound notes
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