Ethyl 3-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylate
Basic information
- CAS
943113-48-2- Standard SMILES
CCOC(=O)c1cn2c(-c3ccc(F)cc3)csc2n1- InChIKey
CDULHIDCLSAAHJ-UHFFFAOYSA-N- Molecular formula
- C14H11FN2O2S
- Average molar mass
- 290.31 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylate
- IUPAC
- ethyl 3-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylate
- English name
- 3-(4-Fluorophenyl)imidazo[2,1-b]thiazole-6-carboxylic acid ethyl ester
- Molecular formula
- C14H11FN2O2S
- Molecular weight
- 290.31
Names & synonyms
AKOS000348523943113-48-23-(4-Fluorophenyl)imidazo[2,1-b]thiazole-6-carboxylic acid ethyl esterImidazo[2,1-b]thiazole-6-carboxylic acid, 3-(4-fluorophenyl)-, ethyl ester
Database identifiers
- CAS
943113-48-2
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 363
Physicochemical properties
- Density
- 1.39 · 1.39±0.1 g/cm3(Predicted)
- pka
- 2.6 · 2.60±0.40(Predicted)
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Compound notes
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