Basic information
- Standard SMILES
Cc1cccc(C(=O)Cl)c1Nc1ccnc2c(C(F)(F)F)cccc12- InChIKey
HLMWRJYCDSNOLA-UHFFFAOYSA-N- Molecular formula
- C18H12ClF3N2O
- Average molar mass
- 364.7 g/mol
Names & identifiers
- Preferred name
- 3-Methyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoyl chloride
- IUPAC
- 3-methyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoyl chloride
Database identifiers
- PubChem CID
- 20520131
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 487
Related reactions
1 records
Compound notes
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