Basic information
- Standard SMILES
CC(C)(NC(=O)c1cnc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2c1)c1ccccn1- InChIKey
YFIPHSOFDXQRSX-UHFFFAOYSA-N- Molecular formula
- C32H25F3N4O2
- Average molar mass
- 554.6 g/mol
- Monoisotopic mass
- 554.19296054
Names & identifiers
- Preferred name
- 7-[(4'-Trifluoromethyl-biphenyl-2-carbonyl)-amino]-quinoline-3-carboxylic acid (1-methyl-1-pyridin-2-yl-ethyl)-amide
- IUPAC
- N-(2-pyridin-2-ylpropan-2-yl)-7-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]quinoline-3-carboxamide
Names & synonyms
7-[(4'-Trifluoromethyl-biphenyl-2-carbonyl)-amino]-quinoline-3-carboxylic acid (1-methyl-1-pyridin-2-yl-ethyl)-amide
Database identifiers
- PubChem CID
- 10144082
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 904
Related reactions
3 records
Compound notes
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