Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(=Cc2cc(F)cc(Oc3ccc(C(F)(F)F)cn3)c2)CC1- InChIKey
HZAZMCYDSSOUOC-UHFFFAOYSA-N- Molecular formula
- C23H24F4N2O3
- Average molar mass
- 452.4 g/mol
- Monoisotopic mass
- 452.17230528
Names & identifiers
- Preferred name
- tert-Butyl 4-(3-fluoro-5-(5-(trifluoromethyl)pyridin-2-yloxy)benzylidene)piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-[[3-fluoro-5-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylidene]piperidine-1-carboxylate
Names & synonyms
tert-Butyl 4-(3-fluoro-5-(5-(trifluoromethyl)pyridin-2-yloxy)benzylidene)piperidine-1-carboxylateSCHEMBL1014193
Database identifiers
- PubChem CID
- 66877003
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 51.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 667
Related reactions
4 records
Compound notes
Loading…