Basic information
- Standard SMILES
COC(=O)c1cn(-c2cc(C(F)(F)F)nc3ccccc23)c2ccccc12- InChIKey
BSXKAOWIRCLKBO-UHFFFAOYSA-N- Molecular formula
- C20H13F3N2O2
- Average molar mass
- 370.3 g/mol
Names & identifiers
- Preferred name
- 3-methoxycarbonyl-1-(2-(trifluoromethyl)quinol-4-yl)-1H-indole
- IUPAC
- methyl 1-[2-(trifluoromethyl)quinolin-4-yl]indole-3-carboxylate
Names & synonyms
3-methoxycarbonyl-1-(2-(trifluoromethyl)quinol-4-yl)-1H-indoleSCHEMBL4240364
Database identifiers
- PubChem CID
- 68970592
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 556
Related reactions
4 records
Compound notes
Loading…