Basic information
- Standard SMILES
Cc1cc(O)c2cc(-c3cccc(C(F)(F)F)c3)nnc2c1- InChIKey
QSKIZYRUCOIXGJ-UHFFFAOYSA-N- Molecular formula
- C16H11F3N2O
- Average molar mass
- 304.27 g/mol
Names & identifiers
- Preferred name
- 7-Methyl-3-(3-trifluoromethylphenyl)cinnolin-5-ol
- IUPAC
- 7-methyl-3-[3-(trifluoromethyl)phenyl]cinnolin-5-ol
Names & synonyms
7-methyl-3-(3-trifluoromethylphenyl)cinnolin-5-olSCHEMBL3921597IYZQWKMTOZZJKR-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 135458024
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 390
Related reactions
7 records
Compound notes
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