Basic information
- Standard SMILES
N#Cc1csc(NC(=O)Cn2c(=O)ccc3cc(C(F)(F)F)ccc32)c1-c1cncs1- InChIKey
HIYYFEOHAYFRAI-UHFFFAOYSA-N- Molecular formula
- C20H11F3N4O2S2
- Average molar mass
- 460.5 g/mol
- Monoisotopic mass
- 460.02755244
Names & identifiers
- Preferred name
- N-(4-Cyano-3-(thiazol-5-yl)thiophen-2-yl)-2-(2-oxo-6-(trifluoromethyl)quinolin-1(2H)-yl)acetamide
- IUPAC
- N-[4-cyano-3-(1,3-thiazol-5-yl)thiophen-2-yl]-2-[2-oxo-6-(trifluoromethyl)quinolin-1-yl]acetamide
Names & synonyms
N-(4-Cyano-3-(thiazol-5-yl)thiophen-2-yl)-2-(2-oxo-6-(trifluoromethyl)quinolin-1(2H)-yl)acetamideSCHEMBL3784008CHEMBL5767001BDBM351696US9796706, Compound 140N-(4-Cyano-3-(thiazol-5-yl)thiophen-2-yl)-2-(2-oxo-6-(trifluoromethyl)quinolin-1 (2H)-yl)acetamide
Database identifiers
- PubChem CID
- 59636675
- ChEMBL
CHEMBL5767001
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 799
Related reactions
3 records
Compound notes
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